N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
type: datablock
datablock name: 7YM
has chem comp category: chem compCategory
has chem comp atom category: chem comp atomCategory
has chem comp bond category: chem comp bondCategory
has pdbx chem comp audit category: pdbx chem comp auditCategory
has pdbx chem comp descriptor category: pdbx chem comp descriptorCategory
has pdbx chem comp identifier category: pdbx chem comp identifierCategory

7YM
type: chem comp
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
chem comp.id: 7YM
chem comp.formula: C24 H23 N9 O4
chem comp.formula weight: 501.497
chem comp.name: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
chem comp.pdbx ambiguous flag: N
chem comp.pdbx formal charge: 0
chem comp.pdbx ideal coordinates details: Corina
chem comp.pdbx ideal coordinates missing flag: N
chem comp.pdbx initial date: 2016-12-13
chem comp.pdbx model coordinates db code: 5PAI
chem comp.pdbx model coordinates missing flag: N
chem comp.pdbx modified date: 2017-06-16
chem comp.pdbx processing site: RCSB
chem comp.pdbx release status: REL
chem comp.pdbx type: HETAIN
chem comp.three letter code: 7YM
chem comp.type: non-polymer

N3,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N3
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: N1
chem comp atom.charge: 0
chem comp atom.model cartn x: 7.925
chem comp atom.model cartn y: 40.091
chem comp atom.model cartn z: 22.257
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: N3
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -0.426
chem comp atom.pdbx model cartn y ideal: -0.619
chem comp atom.pdbx model cartn z ideal: 0.074
chem comp atom.pdbx ordinal: 1
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

C5,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C5
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C1
chem comp atom.charge: 0
chem comp atom.model cartn x: 1.228
chem comp atom.model cartn y: 41.386
chem comp atom.model cartn z: 19.937
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C5
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 8.319
chem comp atom.pdbx model cartn y ideal: 0.994
chem comp atom.pdbx model cartn z ideal: 0.401
chem comp atom.pdbx ordinal: 2
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C7,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C7
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C2
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.501
chem comp atom.model cartn y: 38.790
chem comp atom.model cartn z: 25.578
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C7
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -3.969
chem comp atom.pdbx model cartn y ideal: 0.104
chem comp atom.pdbx model cartn z ideal: -0.257
chem comp atom.pdbx ordinal: 3
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C8,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C8
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C3
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.581
chem comp atom.model cartn y: 34.159
chem comp atom.model cartn z: 30.157
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C8
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -10.324
chem comp atom.pdbx model cartn y ideal: 0.049
chem comp atom.pdbx model cartn z ideal: 0.469
chem comp atom.pdbx ordinal: 4
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C10,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C10
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C4
chem comp atom.charge: 0
chem comp atom.model cartn x: 7.544
chem comp atom.model cartn y: 40.818
chem comp atom.model cartn z: 24.324
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C10
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -1.658
chem comp atom.pdbx model cartn y ideal: 1.206
chem comp atom.pdbx model cartn z ideal: 0.019
chem comp atom.pdbx ordinal: 5
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C13,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C13
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C5
chem comp atom.charge: 0
chem comp atom.model cartn x: -0.077
chem comp atom.model cartn y: 41.492
chem comp atom.model cartn z: 19.387
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C13
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 9.266
chem comp atom.pdbx model cartn y ideal: 0.390
chem comp atom.pdbx model cartn z ideal: -0.465
chem comp atom.pdbx ordinal: 6
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C17,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C17
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C6
chem comp atom.charge: 0
chem comp atom.model cartn x: 3.483
chem comp atom.model cartn y: 41.426
chem comp atom.model cartn z: 19.048
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C17
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 6.308
chem comp atom.pdbx model cartn y ideal: -0.128
chem comp atom.pdbx model cartn z ideal: -0.224
chem comp atom.pdbx ordinal: 7
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C21,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C21
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C7
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.835
chem comp atom.model cartn y: 36.540
chem comp atom.model cartn z: 27.601
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C21
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -6.748
chem comp atom.pdbx model cartn y ideal: 0.319
chem comp atom.pdbx model cartn z ideal: 0.346
chem comp atom.pdbx ordinal: 8
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C22,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C22
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C8
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.399
chem comp atom.model cartn y: 36.615
chem comp atom.model cartn z: 26.335
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C22
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -6.027
chem comp atom.pdbx model cartn y ideal: 1.300
chem comp atom.pdbx model cartn z ideal: -0.315
chem comp atom.pdbx ordinal: 9
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C1,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C1
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C9
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.181
chem comp atom.model cartn y: 39.540
chem comp atom.model cartn z: 24.383
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C1
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -2.508
chem comp atom.pdbx model cartn y ideal: 0.082
chem comp atom.pdbx model cartn z ideal: -0.110
chem comp atom.pdbx ordinal: 10
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C2,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C2
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C10
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.379
chem comp atom.model cartn y: 39.128
chem comp atom.model cartn z: 23.068
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C2
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -1.698
chem comp atom.pdbx model cartn y ideal: -1.047
chem comp atom.pdbx model cartn z ideal: -0.071
chem comp atom.pdbx ordinal: 11
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

N4,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N4
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: N2
chem comp atom.charge: 0
chem comp atom.model cartn x: 7.396
chem comp atom.model cartn y: 41.147
chem comp atom.model cartn z: 23.070
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: N4
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -0.431
chem comp atom.pdbx model cartn y ideal: 0.779
chem comp atom.pdbx model cartn z ideal: 0.127
chem comp atom.pdbx ordinal: 12
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

N6,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N6
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: N3
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.892
chem comp atom.model cartn y: 35.204
chem comp atom.model cartn z: 29.759
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: N6
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -9.119
chem comp atom.pdbx model cartn y ideal: -0.474
chem comp atom.pdbx model cartn z ideal: 0.845
chem comp atom.pdbx ordinal: 13
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

N9,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N9
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: N4
chem comp atom.charge: 0
chem comp atom.model cartn x: -0.819
chem comp atom.model cartn y: 42.047
chem comp atom.model cartn z: 20.320
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: N9
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 10.329
chem comp atom.pdbx model cartn y ideal: 1.139
chem comp atom.pdbx model cartn z ideal: -0.427
chem comp atom.pdbx ordinal: 14
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

N11,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N11
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: N5
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.410
chem comp atom.model cartn y: 33.718
chem comp atom.model cartn z: 29.158
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: N11
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -10.136
chem comp atom.pdbx model cartn y ideal: 1.119
chem comp atom.pdbx model cartn z ideal: -0.262
chem comp atom.pdbx ordinal: 15
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

C12,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C12
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C11
chem comp atom.charge: 0
chem comp atom.model cartn x: 1.145
chem comp atom.model cartn y: 41.904
chem comp atom.model cartn z: 21.197
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C12
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 8.966
chem comp atom.pdbx model cartn y ideal: 2.090
chem comp atom.pdbx model cartn z ideal: 0.877
chem comp atom.pdbx ordinal: 16
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C14,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C14
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C12
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.250
chem comp atom.model cartn y: 35.521
chem comp atom.model cartn z: 28.471
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C14
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -8.133
chem comp atom.pdbx model cartn y ideal: 0.339
chem comp atom.pdbx model cartn z ideal: 0.309
chem comp atom.pdbx ordinal: 17
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

O15,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: O15
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: O1
chem comp atom.charge: 0
chem comp atom.model cartn x: -0.140
chem comp atom.model cartn y: 42.284
chem comp atom.model cartn z: 21.330
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: O15
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 10.184
chem comp atom.pdbx model cartn y ideal: 2.086
chem comp atom.pdbx model cartn z ideal: 0.310
chem comp atom.pdbx ordinal: 18
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O

N16,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N16
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: N6
chem comp atom.charge: 0
chem comp atom.model cartn x: 2.330
chem comp atom.model cartn y: 40.808
chem comp atom.model cartn z: 19.279
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: N16
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 7.012
chem comp atom.pdbx model cartn y ideal: 0.562
chem comp atom.pdbx model cartn z ideal: 0.695
chem comp atom.pdbx ordinal: 19
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

C18,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C18
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C13
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.014
chem comp atom.model cartn y: 40.167
chem comp atom.model cartn z: 20.885
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C18
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 0.708
chem comp atom.pdbx model cartn y ideal: -1.438
chem comp atom.pdbx model cartn z ideal: 0.163
chem comp atom.pdbx ordinal: 20
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C19,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C19
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C14
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.224
chem comp atom.model cartn y: 34.579
chem comp atom.model cartn z: 28.076
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C19
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -8.802
chem comp atom.pdbx model cartn y ideal: 1.353
chem comp atom.pdbx model cartn z ideal: -0.396
chem comp atom.pdbx ordinal: 21
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

N20,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N20
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: N7
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.038
chem comp atom.model cartn y: 37.566
chem comp atom.model cartn z: 25.376
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: N20
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -4.627
chem comp atom.pdbx model cartn y ideal: 1.281
chem comp atom.pdbx model cartn z ideal: -0.279
chem comp atom.pdbx ordinal: 22
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

N23,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N23
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: N8
chem comp atom.charge: 0
chem comp atom.model cartn x: 4.444
chem comp atom.model cartn y: 40.689
chem comp atom.model cartn z: 18.418
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: N23
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 5.098
chem comp atom.pdbx model cartn y ideal: -0.632
chem comp atom.pdbx model cartn z ideal: 0.093
chem comp atom.pdbx ordinal: 23
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

O24,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: O24
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: O2
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.234
chem comp atom.model cartn y: 39.220
chem comp atom.model cartn z: 26.721
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: O24
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -4.586
chem comp atom.pdbx model cartn y ideal: -0.939
chem comp atom.pdbx model cartn z ideal: -0.359
chem comp atom.pdbx ordinal: 24
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O

C25,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C25
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C15
chem comp atom.charge: 0
chem comp atom.model cartn x: 6.888
chem comp atom.model cartn y: 40.635
chem comp atom.model cartn z: 20.176
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C25
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 1.911
chem comp atom.pdbx model cartn y ideal: -1.023
chem comp atom.pdbx model cartn z ideal: -0.393
chem comp atom.pdbx ordinal: 25
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

O26,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: O26
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: O3
chem comp atom.charge: 0
chem comp atom.model cartn x: 3.662
chem comp atom.model cartn y: 42.615
chem comp atom.model cartn z: 19.343
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: O26
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 6.764
chem comp atom.pdbx model cartn y ideal: -0.296
chem comp atom.pdbx model cartn z ideal: -1.338
chem comp atom.pdbx ordinal: 26
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O

O27,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: O27
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: O4
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.955
chem comp atom.model cartn y: 37.983
chem comp atom.model cartn z: 22.652
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: O27
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -2.108
chem comp atom.pdbx model cartn y ideal: -2.333
chem comp atom.pdbx model cartn z ideal: -0.163
chem comp atom.pdbx ordinal: 27
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O

N28,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N28
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: N9
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.456
chem comp atom.model cartn y: 33.591
chem comp atom.model cartn z: 31.416
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: N28
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -11.555
chem comp atom.pdbx model cartn y ideal: -0.475
chem comp atom.pdbx model cartn z ideal: 0.804
chem comp atom.pdbx ordinal: 28
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

C29,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C29
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C16
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.803
chem comp atom.model cartn y: 34.686
chem comp atom.model cartn z: 26.815
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C29
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -8.064
chem comp atom.pdbx model cartn y ideal: 2.336
chem comp atom.pdbx model cartn z ideal: -1.058
chem comp atom.pdbx ordinal: 29
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C30,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C30
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C17
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.340
chem comp atom.model cartn y: 35.660
chem comp atom.model cartn z: 25.955
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C30
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -6.688
chem comp atom.pdbx model cartn y ideal: 2.306
chem comp atom.pdbx model cartn z ideal: -1.014
chem comp atom.pdbx ordinal: 30
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C31,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C31
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C18
chem comp atom.charge: 0
chem comp atom.model cartn x: 6.919
chem comp atom.model cartn y: 40.705
chem comp atom.model cartn z: 18.782
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C31
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 3.027
chem comp atom.pdbx model cartn y ideal: -1.832
chem comp atom.pdbx model cartn z ideal: -0.303
chem comp atom.pdbx ordinal: 31
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C32,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C32
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C19
chem comp atom.charge: 0
chem comp atom.model cartn x: 5.737
chem comp atom.model cartn y: 41.247
chem comp atom.model cartn z: 18.003
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C32
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 4.333
chem comp atom.pdbx model cartn y ideal: -1.382
chem comp atom.pdbx model cartn z ideal: -0.906
chem comp atom.pdbx ordinal: 32
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C33,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C33
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C20
chem comp atom.charge: 0
chem comp atom.model cartn x: 2.263
chem comp atom.model cartn y: 42.038
chem comp atom.model cartn z: 22.227
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C33
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 8.425
chem comp atom.pdbx model cartn y ideal: 3.107
chem comp atom.pdbx model cartn z ideal: 1.848
chem comp atom.pdbx ordinal: 33
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C34,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C34
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C21
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.168
chem comp atom.model cartn y: 39.778
chem comp atom.model cartn z: 20.197
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C34
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 0.633
chem comp atom.pdbx model cartn y ideal: -2.664
chem comp atom.pdbx model cartn z ideal: 0.811
chem comp atom.pdbx ordinal: 34
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C35,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C35
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C22
chem comp atom.charge: 0
chem comp atom.model cartn x: -0.497
chem comp atom.model cartn y: 41.031
chem comp atom.model cartn z: 18.017
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C35
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 9.077
chem comp atom.pdbx model cartn y ideal: -0.870
chem comp atom.pdbx model cartn z ideal: -1.270
chem comp atom.pdbx ordinal: 35
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C36,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C36
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C23
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.153
chem comp atom.model cartn y: 39.884
chem comp atom.model cartn z: 18.801
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C36
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 1.752
chem comp atom.pdbx model cartn y ideal: -3.468
chem comp atom.pdbx model cartn z ideal: 0.897
chem comp atom.pdbx ordinal: 36
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C37,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C37
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: C24
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.056
chem comp atom.model cartn y: 40.349
chem comp atom.model cartn z: 18.066
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C37
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 2.947
chem comp atom.pdbx model cartn y ideal: -3.054
chem comp atom.pdbx model cartn z ideal: 0.338
chem comp atom.pdbx ordinal: 37
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

H1,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H1
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H1
chem comp atom.charge: 0
chem comp atom.model cartn x: 7.237
chem comp atom.model cartn y: 41.411
chem comp atom.model cartn z: 25.173
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H1
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -1.972
chem comp atom.pdbx model cartn y ideal: 2.240
chem comp atom.pdbx model cartn z ideal: 0.027
chem comp atom.pdbx ordinal: 38
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H2,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H2
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H2
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.088
chem comp atom.model cartn y: 37.255
chem comp atom.model cartn z: 27.912
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H2
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -6.232
chem comp atom.pdbx model cartn y ideal: -0.462
chem comp atom.pdbx model cartn z ideal: 0.885
chem comp atom.pdbx ordinal: 39
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H4,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H4
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H4
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.213
chem comp atom.model cartn y: 35.692
chem comp atom.model cartn z: 30.307
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H4
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -8.980
chem comp atom.pdbx model cartn y ideal: -1.266
chem comp atom.pdbx model cartn z ideal: 1.386
chem comp atom.pdbx ordinal: 40
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H6,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H6
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H6
chem comp atom.charge: 0
chem comp atom.model cartn x: 2.238
chem comp atom.model cartn y: 39.864
chem comp atom.model cartn z: 18.963
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H6
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 6.618
chem comp atom.pdbx model cartn y ideal: 0.761
chem comp atom.pdbx model cartn z ideal: 1.559
chem comp atom.pdbx ordinal: 41
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H7,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H7
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H7
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.197
chem comp atom.model cartn y: 37.309
chem comp atom.model cartn z: 24.423
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H7
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -4.130
chem comp atom.pdbx model cartn y ideal: 2.114
chem comp atom.pdbx model cartn z ideal: -0.269
chem comp atom.pdbx ordinal: 42
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H8,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H8
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H8
chem comp atom.charge: 0
chem comp atom.model cartn x: 4.259
chem comp atom.model cartn y: 39.724
chem comp atom.model cartn z: 18.230
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H8
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 4.735
chem comp atom.pdbx model cartn y ideal: -0.497
chem comp atom.pdbx model cartn z ideal: 0.982
chem comp atom.pdbx ordinal: 43
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H9,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H9
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H9
chem comp atom.charge: 0
chem comp atom.model cartn x: 6.001
chem comp atom.model cartn y: 40.939
chem comp atom.model cartn z: 20.712
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H9
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 1.974
chem comp atom.pdbx model cartn y ideal: -0.069
chem comp atom.pdbx model cartn z ideal: -0.895
chem comp atom.pdbx ordinal: 44
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H10,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H10
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H10
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.067
chem comp atom.model cartn y: 32.803
chem comp atom.model cartn z: 31.489
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H10
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -11.609
chem comp atom.pdbx model cartn y ideal: -1.276
chem comp atom.pdbx model cartn z ideal: 1.348
chem comp atom.pdbx ordinal: 45
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H11,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H11
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H11
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.699
chem comp atom.model cartn y: 34.267
chem comp atom.model cartn z: 32.112
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H11
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -12.367
chem comp atom.pdbx model cartn y ideal: -0.042
chem comp atom.pdbx model cartn z ideal: 0.496
chem comp atom.pdbx ordinal: 46
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H12,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H12
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H12
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.599
chem comp atom.model cartn y: 34.020
chem comp atom.model cartn z: 26.516
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H12
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -8.571
chem comp atom.pdbx model cartn y ideal: 3.119
chem comp atom.pdbx model cartn z ideal: -1.602
chem comp atom.pdbx ordinal: 47
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H13,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H13
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H13
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.723
chem comp atom.model cartn y: 35.683
chem comp atom.model cartn z: 24.945
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H13
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -6.119
chem comp atom.pdbx model cartn y ideal: 3.067
chem comp atom.pdbx model cartn z ideal: -1.526
chem comp atom.pdbx ordinal: 48
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H14,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H14
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H14
chem comp atom.charge: 0
chem comp atom.model cartn x: 5.888
chem comp atom.model cartn y: 41.015
chem comp atom.model cartn z: 16.938
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H14
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 4.135
chem comp atom.pdbx model cartn y ideal: -0.743
chem comp atom.pdbx model cartn z ideal: -1.767
chem comp atom.pdbx ordinal: 49
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H15,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H15
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H15
chem comp atom.charge: 0
chem comp atom.model cartn x: 5.703
chem comp atom.model cartn y: 42.338
chem comp atom.model cartn z: 18.140
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H15
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 4.906
chem comp atom.pdbx model cartn y ideal: -2.253
chem comp atom.pdbx model cartn z ideal: -1.224
chem comp atom.pdbx ordinal: 50
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H16,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H16
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H16
chem comp atom.charge: 0
chem comp atom.model cartn x: 1.867
chem comp atom.model cartn y: 42.508
chem comp atom.model cartn z: 23.139
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H16
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 8.658
chem comp atom.pdbx model cartn y ideal: 2.797
chem comp atom.pdbx model cartn z ideal: 2.867
chem comp atom.pdbx ordinal: 51
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H17,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H17
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H17
chem comp atom.charge: 0
chem comp atom.model cartn x: 2.658
chem comp atom.model cartn y: 41.041
chem comp atom.model cartn z: 22.471
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H17
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 8.881
chem comp atom.pdbx model cartn y ideal: 4.077
chem comp atom.pdbx model cartn z ideal: 1.650
chem comp atom.pdbx ordinal: 52
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H18,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H18
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H18
chem comp atom.charge: 0
chem comp atom.model cartn x: 3.070
chem comp atom.model cartn y: 42.661
chem comp atom.model cartn z: 21.813
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H18
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 7.344
chem comp atom.pdbx model cartn y ideal: 3.183
chem comp atom.pdbx model cartn z ideal: 1.730
chem comp atom.pdbx ordinal: 53
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H19,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H19
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H19
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.037
chem comp atom.model cartn y: 39.410
chem comp atom.model cartn z: 20.722
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H19
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -0.301
chem comp atom.pdbx model cartn y ideal: -2.987
chem comp atom.pdbx model cartn z ideal: 1.248
chem comp atom.pdbx ordinal: 54
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H20,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H20
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H20
chem comp atom.charge: 0
chem comp atom.model cartn x: -1.571
chem comp atom.model cartn y: 41.226
chem comp atom.model cartn z: 17.877
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H20
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 8.714
chem comp atom.pdbx model cartn y ideal: -0.615
chem comp atom.pdbx model cartn z ideal: -2.265
chem comp atom.pdbx ordinal: 55
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H21,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H21
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H21
chem comp atom.charge: 0
chem comp atom.model cartn x: 0.077
chem comp atom.model cartn y: 41.578
chem comp atom.model cartn z: 17.254
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H21
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 10.030
chem comp atom.pdbx model cartn y ideal: -1.394
chem comp atom.pdbx model cartn z ideal: -1.353
chem comp atom.pdbx ordinal: 56
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H22,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H22
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H22
chem comp atom.charge: 0
chem comp atom.model cartn x: -0.304
chem comp atom.model cartn y: 39.953
chem comp atom.model cartn z: 17.918
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H22
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 8.351
chem comp atom.pdbx model cartn y ideal: -1.514
chem comp atom.pdbx model cartn z ideal: -0.773
chem comp atom.pdbx ordinal: 57
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H23,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H23
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H23
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.040
chem comp atom.model cartn y: 39.590
chem comp atom.model cartn z: 18.259
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H23
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 1.694
chem comp atom.pdbx model cartn y ideal: -4.421
chem comp atom.pdbx model cartn z ideal: 1.402
chem comp atom.pdbx ordinal: 58
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H24,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H24
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H24
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.092
chem comp atom.model cartn y: 40.428
chem comp atom.model cartn z: 16.989
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H24
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 3.821
chem comp atom.pdbx model cartn y ideal: -3.685
chem comp atom.pdbx model cartn z ideal: 0.407
chem comp atom.pdbx ordinal: 59
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H3,7YM
type: chem comp atom
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H3
chem comp atom.comp id: 7YM
chem comp atom.alt atom id: H3
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.195
chem comp atom.model cartn y: 37.457
chem comp atom.model cartn z: 23.406
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H3
chem comp atom.pdbx component comp id: 7YM
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -2.316
chem comp atom.pdbx model cartn y ideal: -2.742
chem comp atom.pdbx model cartn z ideal: 0.689
chem comp atom.pdbx ordinal: 60
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

C32,N23,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C32
chem comp bond.atom id 2: N23
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 1
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C32,C31,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C32
chem comp bond.atom id 2: C31
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 2
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C35,C13,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C35
chem comp bond.atom id 2: C13
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 3
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C37,C31,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C37
chem comp bond.atom id 2: C31
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 4
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C37,C36,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C37
chem comp bond.atom id 2: C36
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 5
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N23,C17,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N23
chem comp bond.atom id 2: C17
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 6
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C31,C25,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C31
chem comp bond.atom id 2: C25
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 7
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C36,C34,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C36
chem comp bond.atom id 2: C34
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 8
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C17,N16,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C17
chem comp bond.atom id 2: N16
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 9
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C17,O26,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C17
chem comp bond.atom id 2: O26
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 10
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

N16,C5,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N16
chem comp bond.atom id 2: C5
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 11
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C13,C5,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C13
chem comp bond.atom id 2: C5
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 12
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C13,N9,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C13
chem comp bond.atom id 2: N9
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 13
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C5,C12,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: C12
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 14
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C25,C18,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C25
chem comp bond.atom id 2: C18
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 15
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C34,C18,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C34
chem comp bond.atom id 2: C18
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 16
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N9,O15,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N9
chem comp bond.atom id 2: O15
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 17
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C18,N3,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C18
chem comp bond.atom id 2: N3
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 18
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C12,O15,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C12
chem comp bond.atom id 2: O15
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 19
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C12,C33,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C12
chem comp bond.atom id 2: C33
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 20
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N3,C2,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N3
chem comp bond.atom id 2: C2
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 21
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N3,N4,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N3
chem comp bond.atom id 2: N4
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 22
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O27,C2,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: O27
chem comp bond.atom id 2: C2
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 23
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C2,C1,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: C1
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 24
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

N4,C10,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N4
chem comp bond.atom id 2: C10
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 25
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C10,C1,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C10
chem comp bond.atom id 2: C1
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 26
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C1,C7,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: C7
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 27
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N20,C7,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N20
chem comp bond.atom id 2: C7
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 28
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N20,C22,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N20
chem comp bond.atom id 2: C22
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 29
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C7,O24,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C7
chem comp bond.atom id 2: O24
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 30
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C30,C22,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C30
chem comp bond.atom id 2: C22
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 31
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C30,C29,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C30
chem comp bond.atom id 2: C29
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 32
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C22,C21,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C22
chem comp bond.atom id 2: C21
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 33
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C29,C19,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C29
chem comp bond.atom id 2: C19
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 34
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C21,C14,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C21
chem comp bond.atom id 2: C14
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 35
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C19,C14,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C19
chem comp bond.atom id 2: C14
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 36
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C19,N11,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C19
chem comp bond.atom id 2: N11
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 37
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C14,N6,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C14
chem comp bond.atom id 2: N6
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 38
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N11,C8,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N11
chem comp bond.atom id 2: C8
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 39
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

N6,C8,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N6
chem comp bond.atom id 2: C8
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 40
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C8,N28,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: N28
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 41
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C10,H1,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C10
chem comp bond.atom id 2: H1
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 42
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C21,H2,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C21
chem comp bond.atom id 2: H2
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 43
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N6,H4,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N6
chem comp bond.atom id 2: H4
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 44
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N16,H6,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N16
chem comp bond.atom id 2: H6
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 45
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N20,H7,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N20
chem comp bond.atom id 2: H7
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 46
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N23,H8,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N23
chem comp bond.atom id 2: H8
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 47
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C25,H9,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C25
chem comp bond.atom id 2: H9
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 48
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N28,H10,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N28
chem comp bond.atom id 2: H10
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 49
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N28,H11,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: N28
chem comp bond.atom id 2: H11
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 50
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C29,H12,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C29
chem comp bond.atom id 2: H12
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 51
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C30,H13,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C30
chem comp bond.atom id 2: H13
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 52
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C32,H14,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C32
chem comp bond.atom id 2: H14
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 53
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C32,H15,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C32
chem comp bond.atom id 2: H15
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 54
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C33,H16,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C33
chem comp bond.atom id 2: H16
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 55
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C33,H17,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C33
chem comp bond.atom id 2: H17
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 56
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C33,H18,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C33
chem comp bond.atom id 2: H18
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 57
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C34,H19,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C34
chem comp bond.atom id 2: H19
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 58
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C35,H20,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C35
chem comp bond.atom id 2: H20
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 59
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C35,H21,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C35
chem comp bond.atom id 2: H21
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 60
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C35,H22,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C35
chem comp bond.atom id 2: H22
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 61
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C36,H23,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C36
chem comp bond.atom id 2: H23
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 62
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C37,H24,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: C37
chem comp bond.atom id 2: H24
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 63
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O27,H3,7YM
type: chem comp bond
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/7YM/chem_comp_atom/,
chem comp bond.atom id 1: O27
chem comp bond.atom id 2: H3
chem comp bond.comp id: 7YM
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 64
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

Create component,7YM,2016-12-13
type: pdbx chem comp audit
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
pdbx chem comp audit.action type: Create component
pdbx chem comp audit.comp id: 7YM
pdbx chem comp audit.date: 2016-12-13
pdbx chem comp audit.processing site: RCSB

Initial release,7YM,2017-06-21
type: pdbx chem comp audit
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
pdbx chem comp audit.action type: Initial release
pdbx chem comp audit.comp id: 7YM
pdbx chem comp audit.date: 2017-06-21
pdbx chem comp audit.processing site: RCSB

7YM,InChI,1.03,InChI
type: pdbx chem comp descriptor
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: 7YM
pdbx chem comp descriptor.program: InChI
pdbx chem comp descriptor.program version: 1.03
pdbx chem comp descriptor.type: InChI
pdbx chem comp descriptor.descriptor: InChI=1S/C24H23N9O4/c1-12-20(13(2)37-32-12)31-24(36)26-10-14-4-3-5-16(8-14)33-22(35)17(11-27-33)21(34)28-15-6-7-18-19(9-15)30-23(25)29-18/h3-9,11,35H,10H2,1-2H3,(H,28,34)(H3,25,29,30)(H2,26,31,36)

7YM,InChI,1.03,InChIKey
type: pdbx chem comp descriptor
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: 7YM
pdbx chem comp descriptor.program: InChI
pdbx chem comp descriptor.program version: 1.03
pdbx chem comp descriptor.type: InChIKey
pdbx chem comp descriptor.descriptor: XUIGQXOFQZKKAN-UHFFFAOYSA-N

7YM,CACTVS,3.385,SMILES CANONICAL
type: pdbx chem comp descriptor
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: 7YM
pdbx chem comp descriptor.program: CACTVS
pdbx chem comp descriptor.program version: 3.385
pdbx chem comp descriptor.type: SMILES_CANONICAL
pdbx chem comp descriptor.descriptor: Cc1onc(C)c1NC(=O)NCc2cccc(c2)n3ncc(C(=O)Nc4ccc5nc(N)[nH]c5c4)c3O

7YM,CACTVS,3.385,SMILES
type: pdbx chem comp descriptor
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: 7YM
pdbx chem comp descriptor.program: CACTVS
pdbx chem comp descriptor.program version: 3.385
pdbx chem comp descriptor.type: SMILES
pdbx chem comp descriptor.descriptor: Cc1onc(C)c1NC(=O)NCc2cccc(c2)n3ncc(C(=O)Nc4ccc5nc(N)[nH]c5c4)c3O

7YM,OpenEye OEToolkits,2.0.6,SMILES CANONICAL
type: pdbx chem comp descriptor
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: 7YM
pdbx chem comp descriptor.program: OpenEye OEToolkits
pdbx chem comp descriptor.program version: 2.0.6
pdbx chem comp descriptor.type: SMILES_CANONICAL
pdbx chem comp descriptor.descriptor: Cc1c(c(on1)C)NC(=O)NCc2cccc(c2)n3c(c(cn3)C(=O)Nc4ccc5c(c4)[nH]c(n5)N)O

7YM,OpenEye OEToolkits,2.0.6,SMILES
type: pdbx chem comp descriptor
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: 7YM
pdbx chem comp descriptor.program: OpenEye OEToolkits
pdbx chem comp descriptor.program version: 2.0.6
pdbx chem comp descriptor.type: SMILES
pdbx chem comp descriptor.descriptor: Cc1c(c(on1)C)NC(=O)NCc2cccc(c2)n3c(c(cn3)C(=O)Nc4ccc5c(c4)[nH]c(n5)N)O

7YM,OpenEye OEToolkits,2.0.6,SYSTEMATIC NAME
type: pdbx chem comp identifier
of datablock: N-(2-amino-1H-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-hydroxypyrazole-4-carboxamide
reference to chem comp: chem comp
pdbx chem comp identifier.comp id: 7YM
pdbx chem comp identifier.program: OpenEye OEToolkits
pdbx chem comp identifier.program version: 2.0.6
pdbx chem comp identifier.type: SYSTEMATIC NAME
pdbx chem comp identifier.identifier: ~{N}-(2-azanyl-3~{H}-benzimidazol-5-yl)-1-[3-[[(3,5-dimethyl-1,2-oxazol-4-yl)carbamoylamino]methyl]phenyl]-5-oxidanyl-pyrazole-4-carboxamide