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 2022-06-08 _Chem_shift_completeness_list.Assigned_residue_coverage 0.867 _Chem_shift_completeness_list.Chem_shift_fraction 152/262 _Chem_shift_completeness_list.Chem_shift_1H_fraction 146/159 _Chem_shift_completeness_list.Chem_shift_13C_fraction 6/103 _Chem_shift_completeness_list.Bb_chem_shift_fraction 68/150 _Chem_shift_completeness_list.Bb_chem_shift_1H_fraction 62/75 _Chem_shift_completeness_list.Bb_chem_shift_13C_fraction 6/75 _Chem_shift_completeness_list.Sc_chem_shift_fraction 85/127 _Chem_shift_completeness_list.Sc_chem_shift_1H_fraction 84/84 _Chem_shift_completeness_list.Sc_chem_shift_13C_fraction 1/43 _Chem_shift_completeness_list.Arom_chem_shift_fraction 12/24 _Chem_shift_completeness_list.Arom_chem_shift_1H_fraction 12/12 _Chem_shift_completeness_list.Arom_chem_shift_13C_fraction 0/12 _Chem_shift_completeness_list.Methyl_chem_shift_fraction . _Chem_shift_completeness_list.Methyl_chem_shift_1H_fraction . _Chem_shift_completeness_list.Methyl_chem_shift_13C_fraction . _Chem_shift_completeness_list.Entity_polymer_type polypeptide(L) _Chem_shift_completeness_list.Entry_ID 50710 _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_13C_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_13C_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_13C_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_13C_coverage _Chem_shift_completeness_char.Methyl_chem_shift_coverage _Chem_shift_completeness_char.Methyl_chem_shift_1H_coverage _Chem_shift_completeness_char.Methyl_chem_shift_13C_coverage _Chem_shift_completeness_char.Entry_ID _Chem_shift_completeness_char.Assigned_chem_shift_list_ID 1 1 1 ARG 0.571 0.889 0.000 0.200 0.500 0.000 0.700 1.000 0.000 . . . . . . 50710 1 1 1 2 GLY 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . . . . 50710 1 1 1 3 GLY 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . . . . 50710 1 1 1 4 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 1 1 1 5 GLY 0.000 0.000 0.000 0.000 0.000 0.000 . . . . . . . . . 50710 1 1 1 6 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 1 1 1 7 TYR 0.533 1.000 0.000 0.400 1.000 0.000 0.545 1.000 0.000 0.500 1.000 0.000 . . . 50710 1 1 1 8 ASP 0.571 1.000 0.000 0.400 1.000 0.000 0.667 1.000 0.000 . . . . . . 50710 1 1 1 9 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 1 1 1 10 GLY 0.000 0.000 0.000 0.000 0.000 0.000 . . . . . . . . . 50710 1 1 1 11 GLY 0.000 0.000 0.000 0.000 0.000 0.000 . . . . . . . . . 50710 1 1 1 12 TYR 0.533 1.000 0.000 0.400 1.000 0.000 0.545 1.000 0.000 0.500 1.000 0.000 . . . 50710 1 1 1 13 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 1 1 1 14 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 1 1 1 15 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 1 1 1 16 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 1 1 1 17 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 1 1 1 18 GLY 0.000 0.000 0.000 0.000 0.000 0.000 . . . . . . . . . 50710 1 1 1 19 ASP 0.857 1.000 0.667 0.800 1.000 0.667 1.000 1.000 1.000 . . . . . . 50710 1 1 1 20 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 1 1 1 21 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 1 1 1 22 ASN 0.667 1.000 0.000 0.400 1.000 0.000 0.800 1.000 0.000 . . . . . . 50710 1 1 1 23 TYR 0.533 1.000 0.000 0.400 1.000 0.000 0.545 1.000 0.000 0.500 1.000 0.000 . . . 50710 1 1 1 24 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 1 1 1 25 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 1 1 1 26 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 1 1 1 27 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 1 1 1 28 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 1 1 1 29 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 1 1 1 30 ASP 0.571 1.000 0.000 0.400 1.000 0.000 0.667 1.000 0.000 . . . . . . 50710 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 2022-06-08 _Chem_shift_completeness_list.Assigned_residue_coverage 0.867 _Chem_shift_completeness_list.Chem_shift_fraction 305/524 _Chem_shift_completeness_list.Chem_shift_1H_fraction 292/318 _Chem_shift_completeness_list.Chem_shift_13C_fraction 13/206 _Chem_shift_completeness_list.Bb_chem_shift_fraction 137/300 _Chem_shift_completeness_list.Bb_chem_shift_1H_fraction 125/150 _Chem_shift_completeness_list.Bb_chem_shift_13C_fraction 12/150 _Chem_shift_completeness_list.Sc_chem_shift_fraction 171/254 _Chem_shift_completeness_list.Sc_chem_shift_1H_fraction 167/168 _Chem_shift_completeness_list.Sc_chem_shift_13C_fraction 4/86 _Chem_shift_completeness_list.Arom_chem_shift_fraction 24/48 _Chem_shift_completeness_list.Arom_chem_shift_1H_fraction 24/24 _Chem_shift_completeness_list.Arom_chem_shift_13C_fraction 0/24 _Chem_shift_completeness_list.Methyl_chem_shift_fraction . _Chem_shift_completeness_list.Methyl_chem_shift_1H_fraction . _Chem_shift_completeness_list.Methyl_chem_shift_13C_fraction . _Chem_shift_completeness_list.Entity_polymer_type polypeptide(L) _Chem_shift_completeness_list.Entry_ID 50710 _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_13C_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_13C_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_13C_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_13C_coverage _Chem_shift_completeness_char.Methyl_chem_shift_coverage _Chem_shift_completeness_char.Methyl_chem_shift_1H_coverage _Chem_shift_completeness_char.Methyl_chem_shift_13C_coverage _Chem_shift_completeness_char.Entry_ID _Chem_shift_completeness_char.Assigned_chem_shift_list_ID 1 1 1 ARG 0.857 1.000 0.600 1.000 1.000 1.000 0.800 1.000 0.333 . . . . . . 50710 2 1 1 2 GLY 0.000 0.000 0.000 0.000 0.000 0.000 . . . . . . . . . 50710 2 1 1 3 GLY 0.000 0.000 0.000 0.000 0.000 0.000 . . . . . . . . . 50710 2 1 1 4 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 2 1 1 5 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 6 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 7 TYR 0.533 1.000 0.000 0.400 1.000 0.000 0.545 1.000 0.000 0.500 1.000 0.000 . . . 50710 2 1 1 8 ASP 0.571 1.000 0.000 0.400 1.000 0.000 0.667 1.000 0.000 . . . . . . 50710 2 1 1 9 ARG 0.714 1.000 0.200 0.400 1.000 0.000 0.800 1.000 0.333 . . . . . . 50710 2 1 1 10 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 11 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 12 TYR 0.733 1.000 0.429 1.000 1.000 1.000 0.636 1.000 0.200 0.500 1.000 0.000 . . . 50710 2 1 1 13 ARG 0.571 0.889 0.000 0.400 1.000 0.000 0.600 0.857 0.000 . . . . . . 50710 2 1 1 14 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 15 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 16 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 2 1 1 17 GLY 0.000 0.000 0.000 0.000 0.000 0.000 . . . . . . . . . 50710 2 1 1 18 GLY 0.000 0.000 0.000 0.000 0.000 0.000 . . . . . . . . . 50710 2 1 1 19 ASP 0.571 1.000 0.000 0.400 1.000 0.000 0.667 1.000 0.000 . . . . . . 50710 2 1 1 20 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 2 1 1 21 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 22 ASN 0.667 1.000 0.000 0.400 1.000 0.000 0.800 1.000 0.000 . . . . . . 50710 2 1 1 23 TYR 0.533 1.000 0.000 0.400 1.000 0.000 0.545 1.000 0.000 0.500 1.000 0.000 . . . 50710 2 1 1 24 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 2 1 1 25 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 26 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 27 ARG 0.643 1.000 0.000 0.400 1.000 0.000 0.700 1.000 0.000 . . . . . . 50710 2 1 1 28 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 29 GLY 0.600 1.000 0.000 0.600 1.000 0.000 . . . . . . . . . 50710 2 1 1 30 ASP 0.571 1.000 0.000 0.400 1.000 0.000 0.667 1.000 0.000 . . . . . . 50710 2 stop_ save_ save_chem_shift_completeness_list_3 _Chem_shift_completeness_list.Sf_category chem_shift_completeness_list _Chem_shift_completeness_list.Queried_date 2022-06-08 _Chem_shift_completeness_list.Assigned_residue_coverage 1.000 _Chem_shift_completeness_list.Chem_shift_fraction 493/786 _Chem_shift_completeness_list.Chem_shift_1H_fraction 415/477 _Chem_shift_completeness_list.Chem_shift_13C_fraction 78/309 _Chem_shift_completeness_list.Bb_chem_shift_fraction 235/450 _Chem_shift_completeness_list.Bb_chem_shift_1H_fraction 174/225 _Chem_shift_completeness_list.Bb_chem_shift_13C_fraction 61/225 _Chem_shift_completeness_list.Sc_chem_shift_fraction 276/381 _Chem_shift_completeness_list.Sc_chem_shift_1H_fraction 241/252 _Chem_shift_completeness_list.Sc_chem_shift_13C_fraction 35/129 _Chem_shift_completeness_list.Arom_chem_shift_fraction 36/72 _Chem_shift_completeness_list.Arom_chem_shift_1H_fraction 36/36 _Chem_shift_completeness_list.Arom_chem_shift_13C_fraction 0/36 _Chem_shift_completeness_list.Methyl_chem_shift_fraction . _Chem_shift_completeness_list.Methyl_chem_shift_1H_fraction . _Chem_shift_completeness_list.Methyl_chem_shift_13C_fraction . _Chem_shift_completeness_list.Entity_polymer_type polypeptide(L) _Chem_shift_completeness_list.Entry_ID 50710 _Chem_shift_completeness_list.Assigned_chem_shift_list_ID 3 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_13C_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_13C_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_13C_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_13C_coverage _Chem_shift_completeness_char.Methyl_chem_shift_coverage _Chem_shift_completeness_char.Methyl_chem_shift_1H_coverage _Chem_shift_completeness_char.Methyl_chem_shift_13C_coverage _Chem_shift_completeness_char.Entry_ID _Chem_shift_completeness_char.Assigned_chem_shift_list_ID 1 1 1 ARG 0.786 0.778 0.800 0.600 0.500 0.667 0.900 0.857 1.000 . . . . . . 50710 3 1 1 2 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 3 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 4 ARG 0.786 0.778 0.800 0.600 0.500 0.667 0.900 0.857 1.000 . . . . . . 50710 3 1 1 5 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 6 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 7 TYR 0.600 0.875 0.286 0.600 0.500 0.667 0.636 1.000 0.200 0.500 1.000 0.000 . . . 50710 3 1 1 8 ASP 0.714 0.750 0.667 0.600 0.500 0.667 1.000 1.000 1.000 . . . . . . 50710 3 1 1 9 ARG 0.786 0.778 0.800 0.600 0.500 0.667 0.900 0.857 1.000 . . . . . . 50710 3 1 1 10 GLY 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . . . . 50710 3 1 1 11 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 12 TYR 0.600 0.875 0.286 0.600 0.500 0.667 0.636 1.000 0.200 0.500 1.000 0.000 . . . 50710 3 1 1 13 ARG 0.786 0.778 0.800 0.600 0.500 0.667 0.900 0.857 1.000 . . . . . . 50710 3 1 1 14 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 15 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 16 ARG 0.786 0.778 0.800 0.600 0.500 0.667 0.900 0.857 1.000 . . . . . . 50710 3 1 1 17 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 18 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 19 ASP 0.714 0.750 0.667 0.600 0.500 0.667 1.000 1.000 1.000 . . . . . . 50710 3 1 1 20 ARG 0.786 0.778 0.800 0.600 0.500 0.667 0.900 0.857 1.000 . . . . . . 50710 3 1 1 21 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 22 ASN 0.556 0.500 0.667 0.600 0.500 0.667 0.600 0.500 1.000 . . . . . . 50710 3 1 1 23 TYR 0.733 1.000 0.429 1.000 1.000 1.000 0.636 1.000 0.200 0.500 1.000 0.000 . . . 50710 3 1 1 24 ARG 0.786 0.778 0.800 0.600 0.500 0.667 0.900 0.857 1.000 . . . . . . 50710 3 1 1 25 GLY 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . . . . 50710 3 1 1 26 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 27 ARG 0.786 0.778 0.800 0.600 0.500 0.667 0.900 0.857 1.000 . . . . . . 50710 3 1 1 28 GLY 1.000 1.000 1.000 1.000 1.000 1.000 . . . . . . . . . 50710 3 1 1 29 GLY 0.600 0.667 0.500 0.600 0.667 0.500 . . . . . . . . . 50710 3 1 1 30 ASP 0.714 0.750 0.667 0.600 0.500 0.667 1.000 1.000 1.000 . . . . . . 50710 3 stop_ save_