data_chem_shift_completeness_list ############################################ # Completeness of Assigned Chemical Shifts # ############################################ ################################################################### # Excluded atoms in calculation of completeness are listed below. # # https://bmrbpub.pdbj.org/archive/cs_complete/excluded_atoms.str # ################################################################### save_chem_shift_completeness_list_1 _Chem_shift_completeness_list.Sf_category chem_shift_completeness_list _Chem_shift_completeness_list.Queried_date 2020-07-23 _Chem_shift_completeness_list.Assigned_residue_coverage 0.959 _Chem_shift_completeness_list.Chem_shift_fraction 313/361 _Chem_shift_completeness_list.Chem_shift_1H_fraction 263/310 _Chem_shift_completeness_list.Chem_shift_15N_fraction 50/51 _Chem_shift_completeness_list.Bb_chem_shift_fraction 140/145 _Chem_shift_completeness_list.Bb_chem_shift_1H_fraction 94/98 _Chem_shift_completeness_list.Bb_chem_shift_15N_fraction 46/47 _Chem_shift_completeness_list.Sc_chem_shift_fraction 173/216 _Chem_shift_completeness_list.Sc_chem_shift_1H_fraction 169/212 _Chem_shift_completeness_list.Sc_chem_shift_15N_fraction 4/4 _Chem_shift_completeness_list.Arom_chem_shift_fraction 20/32 _Chem_shift_completeness_list.Arom_chem_shift_1H_fraction 19/31 _Chem_shift_completeness_list.Arom_chem_shift_15N_fraction 1/1 _Chem_shift_completeness_list.Methyl_chem_shift_fraction 21/24 _Chem_shift_completeness_list.Methyl_chem_shift_1H_fraction 21/24 _Chem_shift_completeness_list.Entity_polymer_type polypeptide(L) _Chem_shift_completeness_list.Entry_ID 15552 _Chem_shift_completeness_list.Assigned_chem_shift_list_ID 1 loop_ _Chem_shift_completeness_char.Entity_assembly_ID _Chem_shift_completeness_char.Entity_ID _Chem_shift_completeness_char.Comp_index_ID _Chem_shift_completeness_char.Comp_ID _Chem_shift_completeness_char.Chem_shift_coverage _Chem_shift_completeness_char.Chem_shift_1H_coverage _Chem_shift_completeness_char.Chem_shift_15N_coverage _Chem_shift_completeness_char.Bb_chem_shift_coverage _Chem_shift_completeness_char.Bb_chem_shift_1H_coverage _Chem_shift_completeness_char.Bb_chem_shift_15N_coverage _Chem_shift_completeness_char.Sc_chem_shift_coverage _Chem_shift_completeness_char.Sc_chem_shift_1H_coverage _Chem_shift_completeness_char.Sc_chem_shift_15N_coverage _Chem_shift_completeness_char.Arom_chem_shift_coverage _Chem_shift_completeness_char.Arom_chem_shift_1H_coverage _Chem_shift_completeness_char.Arom_chem_shift_15N_coverage _Chem_shift_completeness_char.Methyl_chem_shift_coverage _Chem_shift_completeness_char.Methyl_chem_shift_1H_coverage _Chem_shift_completeness_char.Entry_ID _Chem_shift_completeness_char.Assigned_chem_shift_list_ID 1 1 1 GLY 0.000 0.000 0.000 0.000 0.000 0.000 . . . . . . . . 15552 1 1 1 2 PRO 0.000 0.000 . 0.000 0.000 . 0.000 0.000 . . . . . . 15552 1 1 1 3 LYS 0.636 0.600 1.000 1.000 1.000 1.000 0.500 0.500 . . . . . . 15552 1 1 1 4 LEU 0.875 0.857 1.000 1.000 1.000 1.000 0.800 0.800 . . . . 1.000 1.000 15552 1 1 1 5 LEU 0.875 0.857 1.000 1.000 1.000 1.000 0.800 0.800 . . . . 1.000 1.000 15552 1 1 1 6 ILE 0.875 0.857 1.000 1.000 1.000 1.000 0.800 0.800 . . . . 0.500 0.500 15552 1 1 1 7 THR 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 8 ILE 0.875 0.857 1.000 1.000 1.000 1.000 0.800 0.800 . . . . 0.500 0.500 15552 1 1 1 9 HIS 0.714 0.667 1.000 1.000 1.000 1.000 0.500 0.500 . 0.000 0.000 . . . 15552 1 1 1 10 ASP 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 11 ARG 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 12 LYS 0.636 0.600 1.000 1.000 1.000 1.000 0.500 0.500 . . . . . . 15552 1 1 1 13 GLU 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 14 PHE 0.900 0.889 1.000 1.000 1.000 1.000 0.857 0.857 . 0.800 0.800 . . . 15552 1 1 1 15 ALA 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 16 LYS 0.636 0.600 1.000 1.000 1.000 1.000 0.500 0.500 . . . . . . 15552 1 1 1 17 PHE 0.900 0.889 1.000 1.000 1.000 1.000 0.857 0.857 . 0.800 0.800 . . . 15552 1 1 1 18 GLU 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 19 GLU 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 20 GLU 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 21 ARG 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 22 ALA 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 23 ARG 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 24 ALA 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 25 LYS 0.636 0.600 1.000 1.000 1.000 1.000 0.500 0.500 . . . . . . 15552 1 1 1 26 TRP 0.750 0.700 1.000 1.000 1.000 1.000 0.667 0.625 1.000 0.571 0.500 1.000 . . 15552 1 1 1 27 ASP 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 28 THR 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 29 ALA 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 30 ASN 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . 15552 1 1 1 31 ASN 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . 15552 1 1 1 32 PRO 1.000 1.000 . 1.000 1.000 . 1.000 1.000 . . . . . . 15552 1 1 1 33 LEU 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 34 TYR 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . 1.000 1.000 . . . 15552 1 1 1 35 LYS 0.636 0.600 1.000 1.000 1.000 1.000 0.500 0.500 . . . . . . 15552 1 1 1 36 GLU 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 37 ALA 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 38 THR 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 39 SER 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 40 THR 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 41 PHE 0.700 0.667 1.000 1.000 1.000 1.000 0.571 0.571 . 0.400 0.400 . . . 15552 1 1 1 42 THR 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 43 ASN 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . 15552 1 1 1 44 ILE 0.875 0.857 1.000 1.000 1.000 1.000 0.800 0.800 . . . . 0.500 0.500 15552 1 1 1 45 THR 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 1 1 46 TYR 0.778 0.750 1.000 1.000 1.000 1.000 0.667 0.667 . 0.500 0.500 . . . 15552 1 1 1 47 ARG 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 1 1 1 48 GLY 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . . . 15552 1 1 1 49 THR 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 1 stop_ save_ save_chem_shift_completeness_list_2 _Chem_shift_completeness_list.Sf_category chem_shift_completeness_list _Chem_shift_completeness_list.Queried_date 2020-07-23 _Chem_shift_completeness_list.Assigned_residue_coverage 0.939 _Chem_shift_completeness_list.Chem_shift_fraction 440/722 _Chem_shift_completeness_list.Chem_shift_1H_fraction 340/620 _Chem_shift_completeness_list.Chem_shift_15N_fraction 100/102 _Chem_shift_completeness_list.Bb_chem_shift_fraction 237/290 _Chem_shift_completeness_list.Bb_chem_shift_1H_fraction 145/196 _Chem_shift_completeness_list.Bb_chem_shift_15N_fraction 92/94 _Chem_shift_completeness_list.Sc_chem_shift_fraction 203/432 _Chem_shift_completeness_list.Sc_chem_shift_1H_fraction 195/424 _Chem_shift_completeness_list.Sc_chem_shift_15N_fraction 8/8 _Chem_shift_completeness_list.Arom_chem_shift_fraction 27/64 _Chem_shift_completeness_list.Arom_chem_shift_1H_fraction 25/62 _Chem_shift_completeness_list.Arom_chem_shift_15N_fraction 2/2 _Chem_shift_completeness_list.Methyl_chem_shift_fraction 24/48 _Chem_shift_completeness_list.Methyl_chem_shift_1H_fraction 24/48 _Chem_shift_completeness_list.Entity_polymer_type polypeptide(L) _Chem_shift_completeness_list.Entry_ID 15552 _Chem_shift_completeness_list.Assigned_chem_shift_list_ID 2 loop_ _Chem_shift_completeness_char.Entity_assembly_ID _Chem_shift_completeness_char.Entity_ID _Chem_shift_completeness_char.Comp_index_ID _Chem_shift_completeness_char.Comp_ID _Chem_shift_completeness_char.Chem_shift_coverage _Chem_shift_completeness_char.Chem_shift_1H_coverage _Chem_shift_completeness_char.Chem_shift_15N_coverage _Chem_shift_completeness_char.Bb_chem_shift_coverage _Chem_shift_completeness_char.Bb_chem_shift_1H_coverage _Chem_shift_completeness_char.Bb_chem_shift_15N_coverage _Chem_shift_completeness_char.Sc_chem_shift_coverage _Chem_shift_completeness_char.Sc_chem_shift_1H_coverage _Chem_shift_completeness_char.Sc_chem_shift_15N_coverage _Chem_shift_completeness_char.Arom_chem_shift_coverage _Chem_shift_completeness_char.Arom_chem_shift_1H_coverage _Chem_shift_completeness_char.Arom_chem_shift_15N_coverage _Chem_shift_completeness_char.Methyl_chem_shift_coverage _Chem_shift_completeness_char.Methyl_chem_shift_1H_coverage _Chem_shift_completeness_char.Entry_ID _Chem_shift_completeness_char.Assigned_chem_shift_list_ID 1 1 1 GLY 0.000 0.000 0.000 0.000 0.000 0.000 . . . . . . . . 15552 2 1 1 2 PRO 0.000 0.000 . 0.000 0.000 . 0.000 0.000 . . . . . . 15552 2 1 1 3 LYS 0.182 0.100 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 4 LEU 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 2 1 1 5 LEU 0.250 0.143 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 6 ILE 0.250 0.143 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 7 THR 0.400 0.250 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 8 ILE 0.250 0.143 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 9 HIS 0.286 0.167 1.000 0.667 0.500 1.000 0.000 0.000 . 0.000 0.000 . . . 15552 2 1 1 10 ASP 0.400 0.250 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 11 ARG 0.200 0.111 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 12 LYS 0.182 0.100 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 13 GLU 0.286 0.167 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 14 PHE 0.200 0.111 1.000 0.667 0.500 1.000 0.000 0.000 . 0.000 0.000 . . . 15552 2 1 1 15 ALA 0.500 0.333 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 16 LYS 0.182 0.100 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 17 PHE 0.200 0.111 1.000 0.667 0.500 1.000 0.000 0.000 . 0.000 0.000 . . . 15552 2 1 1 18 GLU 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . 15552 2 1 1 19 GLU 0.286 0.167 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 20 GLU 0.286 0.167 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 21 ARG 0.200 0.111 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 22 ALA 0.500 0.333 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 23 ARG 0.200 0.111 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 24 ALA 0.500 0.333 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 25 LYS 0.182 0.100 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 26 TRP 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . 15552 2 1 1 27 ASP 0.400 0.250 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 28 THR 0.400 0.250 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 29 ALA 0.500 0.333 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 30 ASN 0.625 0.500 1.000 0.667 0.500 1.000 0.600 0.500 1.000 . . . . . 15552 2 1 1 31 ASN 0.625 0.500 1.000 0.667 0.500 1.000 0.600 0.500 1.000 . . . . . 15552 2 1 1 32 PRO 0.000 0.000 . 0.000 0.000 . 0.000 0.000 . . . . . . 15552 2 1 1 33 LEU 0.250 0.143 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 34 TYR 0.556 0.500 1.000 1.000 1.000 1.000 0.333 0.333 . 0.000 0.000 . . . 15552 2 1 1 35 LYS 0.182 0.100 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 36 GLU 0.286 0.167 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 37 ALA 1.000 1.000 1.000 1.000 1.000 1.000 1.000 1.000 . . . . 1.000 1.000 15552 2 1 1 38 THR 0.400 0.250 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 39 SER 0.400 0.250 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 40 THR 0.400 0.250 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 41 PHE 0.200 0.111 1.000 0.667 0.500 1.000 0.000 0.000 . 0.000 0.000 . . . 15552 2 1 1 42 THR 0.400 0.250 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 43 ASN 0.625 0.500 1.000 0.667 0.500 1.000 0.600 0.500 1.000 . . . . . 15552 2 1 1 44 ILE 0.250 0.143 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 45 THR 0.400 0.250 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 1 1 46 TYR 0.222 0.125 1.000 0.667 0.500 1.000 0.000 0.000 . 0.000 0.000 . . . 15552 2 1 1 47 ARG 0.200 0.111 1.000 0.667 0.500 1.000 0.000 0.000 . . . . . . 15552 2 1 1 48 GLY 0.500 0.333 1.000 0.500 0.333 1.000 . . . . . . . . 15552 2 1 1 49 THR 0.400 0.250 1.000 0.667 0.500 1.000 0.000 0.000 . . . . 0.000 0.000 15552 2 stop_ save_