data_0 # _entry.id 0 # _struct_asym.id A _struct_asym.entity_id 0 # _entity_poly.entity_id 0 _entity_poly.type polypeptide(L) _entity_poly.pdbx_strand_id A # _entity.id 0 _entity.type polymer # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id 0 1 MET 0 2 LYS 0 3 PHE 0 4 TYR 0 5 PHE 0 6 VAL 0 7 ILE 0 8 SER 0 9 LEU 0 10 LEU 0 11 LEU 0 12 SER 0 13 LEU 0 14 ALA 0 15 VAL 0 16 ILE 0 17 THR 0 18 THR 0 19 ASN 0 20 ASP 0 21 PRO 0 22 TYR 0 23 ASP 0 24 PHE 0 25 ASP 0 26 VAL 0 27 ILE 0 28 GLU 0 29 ASP 0 30 THR 0 31 SER 0 32 SER 0 33 ASP 0 34 HIS 0 35 ARG 0 36 GLY 0 37 ALA 0 38 VAL 0 39 ARG 0 40 MET 0 41 ARG 0 42 ASP 0 43 GLY 0 44 ASN 0 45 SER # loop_ _chem_comp.id _chem_comp.type _chem_comp.name ALA 'L-peptide linking' ALANINE ARG 'L-peptide linking' ARGININE ASN 'L-peptide linking' ASPARAGINE ASP 'L-peptide linking' 'ASPARTIC ACID' CYS 'L-peptide linking' CYSTEINE GLN 'L-peptide linking' GLUTAMINE GLU 'L-peptide linking' 'GLUTAMIC ACID' HIS 'L-peptide linking' HISTIDINE ILE 'L-peptide linking' ISOLEUCINE LEU 'L-peptide linking' LEUCINE LYS 'L-peptide linking' LYSINE MET 'L-peptide linking' METHIONINE PHE 'L-peptide linking' PHENYLALANINE PRO 'L-peptide linking' PROLINE SER 'L-peptide linking' SERINE THR 'L-peptide linking' THREONINE TRP 'L-peptide linking' TRYPTOPHAN TYR 'L-peptide linking' TYROSINE VAL 'L-peptide linking' VALINE GLY 'peptide linking' GLYCINE # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 0 1 . -13.897 -0.285 20.331 1.00 72.32 1 A 1 ATOM 2 C CA . MET A 0 1 . -13.920 0.811 19.332 1.00 72.32 1 A 1 ATOM 3 C C . MET A 0 1 . -12.705 0.845 18.396 1.00 72.32 1 A 1 ATOM 4 C CB . MET A 0 1 . -14.229 2.175 19.973 1.00 72.32 1 A 1 ATOM 5 O O . MET A 0 1 . -12.910 1.095 17.220 1.00 72.32 1 A 1 ATOM 6 C CG . MET A 0 1 . -15.601 2.171 20.670 1.00 72.32 1 A 1 ATOM 7 S SD . MET A 0 1 . -16.922 1.401 19.691 1.00 72.32 1 A 1 ATOM 8 C CE . MET A 0 1 . -18.360 1.678 20.765 1.00 72.32 1 A 1 ATOM 9 N N . LYS A 0 2 . -11.470 0.528 18.833 1.00 77.06 2 A 1 ATOM 10 C CA . LYS A 0 2 . -10.250 0.618 17.988 1.00 77.06 2 A 1 ATOM 11 C C . LYS A 0 2 . -10.246 -0.230 16.692 1.00 77.06 2 A 1 ATOM 12 C CB . LYS A 0 2 . -9.017 0.323 18.874 1.00 77.06 2 A 1 ATOM 13 O O . LYS A 0 2 . -9.550 0.130 15.755 1.00 77.06 2 A 1 ATOM 14 C CG . LYS A 0 2 . -7.665 0.608 18.190 1.00 77.06 2 A 1 ATOM 15 C CD . LYS A 0 2 . -6.479 0.484 19.163 1.00 77.06 2 A 1 ATOM 16 C CE . LYS A 0 2 . -5.159 0.742 18.420 1.00 77.06 2 A 1 ATOM 17 N NZ . LYS A 0 2 . -3.979 0.729 19.326 1.00 77.06 2 A 1 ATOM 18 N N . PHE A 0 3 . -11.017 -1.320 16.610 1.00 89.73 3 A 1 ATOM 19 C CA . PHE A 0 3 . -11.009 -2.217 15.440 1.00 89.73 3 A 1 ATOM 20 C C . PHE A 0 3 . -11.666 -1.607 14.189 1.00 89.73 3 A 1 ATOM 21 C CB . PHE A 0 3 . -11.676 -3.543 15.831 1.00 89.73 3 A 1 ATOM 22 O O . PHE A 0 3 . -11.149 -1.752 13.085 1.00 89.73 3 A 1 ATOM 23 C CG . PHE A 0 3 . -11.425 -4.671 14.850 1.00 89.73 3 A 1 ATOM 24 C CD1 . PHE A 0 3 . -12.453 -5.132 14.006 1.00 89.73 3 A 1 ATOM 25 C CD2 . PHE A 0 3 . -10.158 -5.286 14.805 1.00 89.73 3 A 1 ATOM 26 C CE1 . PHE A 0 3 . -12.215 -6.214 13.139 1.00 89.73 3 A 1 ATOM 27 C CE2 . PHE A 0 3 . -9.916 -6.347 13.916 1.00 89.73 3 A 1 ATOM 28 C CZ . PHE A 0 3 . -10.945 -6.810 13.081 1.00 89.73 3 A 1 ATOM 29 N N . TYR A 0 4 . -12.757 -0.852 14.362 1.00 90.45 4 A 1 ATOM 30 C CA . TYR A 0 4 . -13.475 -0.230 13.244 1.00 90.45 4 A 1 ATOM 31 C C . TYR A 0 4 . -12.644 0.835 12.522 1.00 90.45 4 A 1 ATOM 32 C CB . TYR A 0 4 . -14.790 0.374 13.751 1.00 90.45 4 A 1 ATOM 33 O O . TYR A 0 4 . -12.798 0.997 11.318 1.00 90.45 4 A 1 ATOM 34 C CG . TYR A 0 4 . -15.699 -0.624 14.440 1.00 90.45 4 A 1 ATOM 35 C CD1 . TYR A 0 4 . -16.222 -1.709 13.710 1.00 90.45 4 A 1 ATOM 36 C CD2 . TYR A 0 4 . -16.030 -0.465 15.801 1.00 90.45 4 A 1 ATOM 37 C CE1 . TYR A 0 4 . -17.066 -2.641 14.341 1.00 90.45 4 A 1 ATOM 38 C CE2 . TYR A 0 4 . -16.886 -1.390 16.432 1.00 90.45 4 A 1 ATOM 39 O OH . TYR A 0 4 . -18.237 -3.377 16.288 1.00 90.45 4 A 1 ATOM 40 C CZ . TYR A 0 4 . -17.404 -2.481 15.698 1.00 90.45 4 A 1 ATOM 41 N N . PHE A 0 5 . -11.724 1.495 13.237 1.00 93.18 5 A 1 ATOM 42 C CA . PHE A 0 5 . -10.788 2.464 12.660 1.00 93.18 5 A 1 ATOM 43 C C . PHE A 0 5 . -9.872 1.827 11.606 1.00 93.18 5 A 1 ATOM 44 C CB . PHE A 0 5 . -9.956 3.081 13.793 1.00 93.18 5 A 1 ATOM 45 O O . PHE A 0 5 . -9.605 2.425 10.568 1.00 93.18 5 A 1 ATOM 46 C CG . PHE A 0 5 . -8.895 4.049 13.311 1.00 93.18 5 A 1 ATOM 47 C CD1 . PHE A 0 5 . -7.549 3.640 13.213 1.00 93.18 5 A 1 ATOM 48 C CD2 . PHE A 0 5 . -9.261 5.347 12.913 1.00 93.18 5 A 1 ATOM 49 C CE1 . PHE A 0 5 . -6.576 4.531 12.726 1.00 93.18 5 A 1 ATOM 50 C CE2 . PHE A 0 5 . -8.288 6.237 12.427 1.00 93.18 5 A 1 ATOM 51 C CZ . PHE A 0 5 . -6.946 5.829 12.334 1.00 93.18 5 A 1 ATOM 52 N N . VAL A 0 6 . -9.415 0.593 11.850 1.00 92.50 6 A 1 ATOM 53 C CA . VAL A 0 6 . -8.548 -0.128 10.909 1.00 92.50 6 A 1 ATOM 54 C C . VAL A 0 6 . -9.332 -0.511 9.658 1.00 92.50 6 A 1 ATOM 55 C CB . VAL A 0 6 . -7.914 -1.369 11.563 1.00 92.50 6 A 1 ATOM 56 O O . VAL A 0 6 . -8.862 -0.273 8.552 1.00 92.50 6 A 1 ATOM 57 C CG1 . VAL A 0 6 . -6.986 -2.108 10.592 1.00 92.50 6 A 1 ATOM 58 C CG2 . VAL A 0 6 . -7.094 -0.977 12.801 1.00 92.50 6 A 1 ATOM 59 N N . ILE A 0 7 . -10.551 -1.035 9.820 1.00 93.89 7 A 1 ATOM 60 C CA . ILE A 0 7 . -11.409 -1.394 8.682 1.00 93.89 7 A 1 ATOM 61 C C . ILE A 0 7 . -11.744 -0.150 7.851 1.00 93.89 7 A 1 ATOM 62 C CB . ILE A 0 7 . -12.685 -2.124 9.157 1.00 93.89 7 A 1 ATOM 63 O O . ILE A 0 7 . -11.632 -0.191 6.628 1.00 93.89 7 A 1 ATOM 64 C CG1 . ILE A 0 7 . -12.320 -3.452 9.858 1.00 93.89 7 A 1 ATOM 65 C CG2 . ILE A 0 7 . -13.619 -2.399 7.961 1.00 93.89 7 A 1 ATOM 66 C CD1 . ILE A 0 7 . -13.495 -4.082 10.611 1.00 93.89 7 A 1 ATOM 67 N N . SER A 0 8 . -12.096 0.971 8.493 1.00 91.65 8 A 1 ATOM 68 C CA . SER A 0 8 . -12.380 2.218 7.775 1.00 91.65 8 A 1 ATOM 69 C C . SER A 0 8 . -11.154 2.758 7.040 1.00 91.65 8 A 1 ATOM 70 C CB . SER A 0 8 . -12.953 3.291 8.709 1.00 91.65 8 A 1 ATOM 71 O O . SER A 0 8 . -11.283 3.230 5.914 1.00 91.65 8 A 1 ATOM 72 O OG . SER A 0 8 . -12.076 3.643 9.765 1.00 91.65 8 A 1 ATOM 73 N N . LEU A 0 9 . -9.965 2.656 7.645 1.00 91.95 9 A 1 ATOM 74 C CA . LEU A 0 9 . -8.716 3.089 7.022 1.00 91.95 9 A 1 ATOM 75 C C . LEU A 0 9 . -8.385 2.236 5.789 1.00 91.95 9 A 1 ATOM 76 C CB . LEU A 0 9 . -7.599 3.046 8.079 1.00 91.95 9 A 1 ATOM 77 O O . LEU A 0 9 . -8.112 2.784 4.724 1.00 91.95 9 A 1 ATOM 78 C CG . LEU A 0 9 . -6.222 3.507 7.569 1.00 91.95 9 A 1 ATOM 79 C CD1 . LEU A 0 9 . -6.224 4.984 7.172 1.00 91.95 9 A 1 ATOM 80 C CD2 . LEU A 0 9 . -5.188 3.304 8.678 1.00 91.95 9 A 1 ATOM 81 N N . LEU A 0 10 . -8.474 0.909 5.904 1.00 90.40 10 A 1 ATOM 82 C CA . LEU A 0 10 . -8.198 -0.006 4.793 1.00 90.40 10 A 1 ATOM 83 C C . LEU A 0 10 . -9.187 0.172 3.635 1.00 90.40 10 A 1 ATOM 84 C CB . LEU A 0 10 . -8.211 -1.455 5.305 1.00 90.40 10 A 1 ATOM 85 O O . LEU A 0 10 . -8.772 0.173 2.480 1.00 90.40 10 A 1 ATOM 86 C CG . LEU A 0 10 . -7.045 -1.814 6.245 1.00 90.40 10 A 1 ATOM 87 C CD1 . LEU A 0 10 . -7.253 -3.232 6.780 1.00 90.40 10 A 1 ATOM 88 C CD2 . LEU A 0 10 . -5.685 -1.751 5.548 1.00 90.40 10 A 1 ATOM 89 N N . LEU A 0 11 . -10.473 0.386 3.932 1.00 91.20 11 A 1 ATOM 90 C CA . LEU A 0 11 . -11.476 0.684 2.907 1.00 91.20 11 A 1 ATOM 91 C C . LEU A 0 11 . -11.179 2.004 2.186 1.00 91.20 11 A 1 ATOM 92 C CB . LEU A 0 11 . -12.878 0.711 3.537 1.00 91.20 11 A 1 ATOM 93 O O . LEU A 0 11 . -11.276 2.053 0.964 1.00 91.20 11 A 1 ATOM 94 C CG . LEU A 0 11 . -13.454 -0.682 3.845 1.00 91.20 11 A 1 ATOM 95 C CD1 . LEU A 0 11 . -14.720 -0.527 4.691 1.00 91.20 11 A 1 ATOM 96 C CD2 . LEU A 0 11 . -13.829 -1.447 2.573 1.00 91.20 11 A 1 ATOM 97 N N . SER A 0 12 . -10.779 3.056 2.912 1.00 89.64 12 A 1 ATOM 98 C CA . SER A 0 12 . -10.405 4.323 2.271 1.00 89.64 12 A 1 ATOM 99 C C . SER A 0 12 . -9.194 4.176 1.348 1.00 89.64 12 A 1 ATOM 100 C CB . SER A 0 12 . -10.184 5.435 3.301 1.00 89.64 12 A 1 ATOM 101 O O . SER A 0 12 . -9.222 4.690 0.233 1.00 89.64 12 A 1 ATOM 102 O OG . SER A 0 12 . -9.064 5.234 4.143 1.00 89.64 12 A 1 ATOM 103 N N . LEU A 0 13 . -8.173 3.418 1.766 1.00 85.25 13 A 1 ATOM 104 C CA . LEU A 0 13 . -6.977 3.190 0.960 1.00 85.25 13 A 1 ATOM 105 C C . LEU A 0 13 . -7.300 2.398 -0.313 1.00 85.25 13 A 1 ATOM 106 C CB . LEU A 0 13 . -5.912 2.493 1.825 1.00 85.25 13 A 1 ATOM 107 O O . LEU A 0 13 . -6.861 2.795 -1.382 1.00 85.25 13 A 1 ATOM 108 C CG . LEU A 0 13 . -4.528 2.400 1.152 1.00 85.25 13 A 1 ATOM 109 C CD1 . LEU A 0 13 . -3.880 3.776 0.978 1.00 85.25 13 A 1 ATOM 110 C CD2 . LEU A 0 13 . -3.604 1.544 2.020 1.00 85.25 13 A 1 ATOM 111 N N . ALA A 0 14 . -8.119 1.345 -0.220 1.00 85.00 14 A 1 ATOM 112 C CA . ALA A 0 14 . -8.512 0.532 -1.374 1.00 85.00 14 A 1 ATOM 113 C C . ALA A 0 14 . -9.284 1.332 -2.441 1.00 85.00 14 A 1 ATOM 114 C CB . ALA A 0 14 . -9.353 -0.643 -0.859 1.00 85.00 14 A 1 ATOM 115 O O . ALA A 0 14 . -9.116 1.111 -3.642 1.00 85.00 14 A 1 ATOM 116 N N . VAL A 0 15 . -10.132 2.274 -2.013 1.00 86.68 15 A 1 ATOM 117 C CA . VAL A 0 15 . -10.863 3.158 -2.935 1.00 86.68 15 A 1 ATOM 118 C C . VAL A 0 15 . -9.918 4.149 -3.608 1.00 86.68 15 A 1 ATOM 119 C CB . VAL A 0 15 . -12.007 3.896 -2.216 1.00 86.68 15 A 1 ATOM 120 O O . VAL A 0 15 . -10.069 4.384 -4.807 1.00 86.68 15 A 1 ATOM 121 C CG1 . VAL A 0 15 . -12.703 4.927 -3.117 1.00 86.68 15 A 1 ATOM 122 C CG2 . VAL A 0 15 . -13.085 2.903 -1.763 1.00 86.68 15 A 1 ATOM 123 N N . ILE A 0 16 . -8.953 4.702 -2.864 1.00 80.85 16 A 1 ATOM 124 C CA . ILE A 0 16 . -7.932 5.590 -3.425 1.00 80.85 16 A 1 ATOM 125 C C . ILE A 0 16 . -7.105 4.812 -4.442 1.00 80.85 16 A 1 ATOM 126 C CB . ILE A 0 16 . -7.085 6.273 -2.329 1.00 80.85 16 A 1 ATOM 127 O O . ILE A 0 16 . -7.173 5.169 -5.602 1.00 80.85 16 A 1 ATOM 128 C CG1 . ILE A 0 16 . -7.973 7.234 -1.503 1.00 80.85 16 A 1 ATOM 129 C CG2 . ILE A 0 16 . -5.912 7.059 -2.948 1.00 80.85 16 A 1 ATOM 130 C CD1 . ILE A 0 16 . -7.339 7.666 -0.175 1.00 80.85 16 A 1 ATOM 131 N N . THR A 0 17 . -6.458 3.697 -4.086 1.00 73.54 17 A 1 ATOM 132 C CA . THR A 0 17 . -5.583 2.946 -5.012 1.00 73.54 17 A 1 ATOM 133 C C . THR A 0 17 . -6.285 2.479 -6.289 1.00 73.54 17 A 1 ATOM 134 C CB . THR A 0 17 . -4.963 1.709 -4.340 1.00 73.54 17 A 1 ATOM 135 O O . THR A 0 17 . -5.653 2.396 -7.329 1.00 73.54 17 A 1 ATOM 136 C CG2 . THR A 0 17 . -4.041 2.071 -3.175 1.00 73.54 17 A 1 ATOM 137 O OG1 . THR A 0 17 . -5.965 0.840 -3.850 1.00 73.54 17 A 1 ATOM 138 N N . THR A 0 18 . -7.590 2.183 -6.242 1.00 76.43 18 A 1 ATOM 139 C CA . THR A 0 18 . -8.346 1.783 -7.448 1.00 76.43 18 A 1 ATOM 140 C C . THR A 0 18 . -8.642 2.964 -8.380 1.00 76.43 18 A 1 ATOM 141 C CB . THR A 0 18 . -9.671 1.097 -7.071 1.00 76.43 18 A 1 ATOM 142 O O . THR A 0 18 . -8.793 2.773 -9.583 1.00 76.43 18 A 1 ATOM 143 C CG2 . THR A 0 18 . -10.391 0.474 -8.269 1.00 76.43 18 A 1 ATOM 144 O OG1 . THR A 0 18 . -9.460 0.045 -6.153 1.00 76.43 18 A 1 ATOM 145 N N . ASN A 0 19 . -8.766 4.179 -7.837 1.00 72.66 19 A 1 ATOM 146 C CA . ASN A 0 19 . -9.052 5.393 -8.607 1.00 72.66 19 A 1 ATOM 147 C C . ASN A 0 19 . -7.838 6.321 -8.739 1.00 72.66 19 A 1 ATOM 148 C CB . ASN A 0 19 . -10.235 6.147 -7.974 1.00 72.66 19 A 1 ATOM 149 O O . ASN A 0 19 . -7.981 7.388 -9.333 1.00 72.66 19 A 1 ATOM 150 C CG . ASN A 0 19 . -11.536 5.380 -8.037 1.00 72.66 19 A 1 ATOM 151 N ND2 . ASN A 0 19 . -11.959 4.806 -6.938 1.00 72.66 19 A 1 ATOM 152 O OD1 . ASN A 0 19 . -12.203 5.293 -9.053 1.00 72.66 19 A 1 ATOM 153 N N . ASP A 0 20 . -6.690 5.974 -8.156 1.00 65.32 20 A 1 ATOM 154 C CA . ASP A 0 20 . -5.519 6.837 -8.102 1.00 65.32 20 A 1 ATOM 155 C C . ASP A 0 20 . -4.832 6.810 -9.472 1.00 65.32 20 A 1 ATOM 156 C CB . ASP A 0 20 . -4.559 6.439 -6.959 1.00 65.32 20 A 1 ATOM 157 O O . ASP A 0 20 . -4.256 5.788 -9.846 1.00 65.32 20 A 1 ATOM 158 C CG . ASP A 0 20 . -3.569 7.553 -6.623 1.00 65.32 20 A 1 ATOM 159 O OD1 . ASP A 0 20 . -3.476 8.499 -7.435 1.00 65.32 20 A 1 ATOM 160 O OD2 . ASP A 0 20 . -2.996 7.515 -5.511 1.00 65.32 20 A 1 ATOM 161 N N . PRO A 0 21 . -4.883 7.903 -10.256 1.00 63.39 21 A 1 ATOM 162 C CA . PRO A 0 21 . -4.157 7.966 -11.519 1.00 63.39 21 A 1 ATOM 163 C C . PRO A 0 21 . -2.633 7.939 -11.314 1.00 63.39 21 A 1 ATOM 164 C CB . PRO A 0 21 . -4.627 9.270 -12.169 1.00 63.39 21 A 1 ATOM 165 O O . PRO A 0 21 . -1.900 7.857 -12.297 1.00 63.39 21 A 1 ATOM 166 C CG . PRO A 0 21 . -4.913 10.168 -10.967 1.00 63.39 21 A 1 ATOM 167 C CD . PRO A 0 21 . -5.487 9.193 -9.949 1.00 63.39 21 A 1 ATOM 168 N N . TYR A 0 22 . -2.157 8.036 -10.067 1.00 60.08 22 A 1 ATOM 169 C CA . TYR A 0 22 . -0.750 8.019 -9.683 1.00 60.08 22 A 1 ATOM 170 C C . TYR A 0 22 . -0.276 6.640 -9.203 1.00 60.08 22 A 1 ATOM 171 C CB . TYR A 0 22 . -0.481 9.127 -8.651 1.00 60.08 22 A 1 ATOM 172 O O . TYR A 0 22 . 0.548 6.558 -8.290 1.00 60.08 22 A 1 ATOM 173 C CG . TYR A 0 22 . -0.934 10.510 -9.081 1.00 60.08 22 A 1 ATOM 174 C CD1 . TYR A 0 22 . -0.232 11.183 -10.096 1.00 60.08 22 A 1 ATOM 175 C CD2 . TYR A 0 22 . -2.050 11.121 -8.478 1.00 60.08 22 A 1 ATOM 176 C CE1 . TYR A 0 22 . -0.646 12.463 -10.512 1.00 60.08 22 A 1 ATOM 177 C CE2 . TYR A 0 22 . -2.481 12.392 -8.899 1.00 60.08 22 A 1 ATOM 178 O OH . TYR A 0 22 . -2.181 14.296 -10.321 1.00 60.08 22 A 1 ATOM 179 C CZ . TYR A 0 22 . -1.777 13.063 -9.916 1.00 60.08 22 A 1 ATOM 180 N N . ASP A 0 23 . -0.762 5.552 -9.811 1.00 62.67 23 A 1 ATOM 181 C CA . ASP A 0 23 . -0.113 4.252 -9.648 1.00 62.67 23 A 1 ATOM 182 C C . ASP A 0 23 . 1.295 4.298 -10.262 1.00 62.67 23 A 1 ATOM 183 C CB . ASP A 0 23 . -0.956 3.091 -10.189 1.00 62.67 23 A 1 ATOM 184 O O . ASP A 0 23 . 1.517 4.294 -11.476 1.00 62.67 23 A 1 ATOM 185 C CG . ASP A 0 23 . -0.380 1.730 -9.770 1.00 62.67 23 A 1 ATOM 186 O OD1 . ASP A 0 23 . 0.654 1.729 -9.058 1.00 62.67 23 A 1 ATOM 187 O OD2 . ASP A 0 23 . -1.001 0.717 -10.156 1.00 62.67 23 A 1 ATOM 188 N N . PHE A 0 24 . 2.262 4.400 -9.365 1.00 60.36 24 A 1 ATOM 189 C CA . PHE A 0 24 . 3.685 4.434 -9.630 1.00 60.36 24 A 1 ATOM 190 C C . PHE A 0 24 . 4.250 3.058 -10.036 1.00 60.36 24 A 1 ATOM 191 C CB . PHE A 0 24 . 4.339 5.024 -8.378 1.00 60.36 24 A 1 ATOM 192 O O . PHE A 0 24 . 5.462 2.910 -10.167 1.00 60.36 24 A 1 ATOM 193 C CG . PHE A 0 24 . 4.281 6.544 -8.245 1.00 60.36 24 A 1 ATOM 194 C CD1 . PHE A 0 24 . 4.909 7.413 -9.164 1.00 60.36 24 A 1 ATOM 195 C CD2 . PHE A 0 24 . 3.573 7.098 -7.164 1.00 60.36 24 A 1 ATOM 196 C CE1 . PHE A 0 24 . 4.869 8.806 -8.976 1.00 60.36 24 A 1 ATOM 197 C CE2 . PHE A 0 24 . 3.511 8.490 -6.986 1.00 60.36 24 A 1 ATOM 198 C CZ . PHE A 0 24 . 4.170 9.346 -7.884 1.00 60.36 24 A 1 ATOM 199 N N . ASP A 0 25 . 3.418 2.061 -10.328 1.00 61.27 25 A 1 ATOM 200 C CA . ASP A 0 25 . 3.857 0.902 -11.112 1.00 61.27 25 A 1 ATOM 201 C C . ASP A 0 25 . 4.171 1.295 -12.575 1.00 61.27 25 A 1 ATOM 202 C CB . ASP A 0 25 . 2.816 -0.220 -10.990 1.00 61.27 25 A 1 ATOM 203 O O . ASP A 0 25 . 4.925 0.607 -13.262 1.00 61.27 25 A 1 ATOM 204 C CG . ASP A 0 25 . 2.793 -0.897 -9.603 1.00 61.27 25 A 1 ATOM 205 O OD1 . ASP A 0 25 . 3.696 -0.626 -8.771 1.00 61.27 25 A 1 ATOM 206 O OD2 . ASP A 0 25 . 1.955 -1.811 -9.425 1.00 61.27 25 A 1 ATOM 207 N N . VAL A 0 26 . 3.702 2.472 -13.024 1.00 56.23 26 A 1 ATOM 208 C CA . VAL A 0 26 . 4.232 3.214 -14.189 1.00 56.23 26 A 1 ATOM 209 C C . VAL A 0 26 . 5.358 4.176 -13.761 1.00 56.23 26 A 1 ATOM 210 C CB . VAL A 0 26 . 3.118 3.910 -15.015 1.00 56.23 26 A 1 ATOM 211 O O . VAL A 0 26 . 5.592 5.208 -14.387 1.00 56.23 26 A 1 ATOM 212 C CG1 . VAL A 0 26 . 3.583 4.371 -16.414 1.00 56.23 26 A 1 ATOM 213 C CG2 . VAL A 0 26 . 1.940 2.960 -15.282 1.00 56.23 26 A 1 ATOM 214 N N . ILE A 0 27 . 6.117 3.877 -12.700 1.00 53.28 27 A 1 ATOM 215 C CA . ILE A 0 27 . 7.485 4.397 -12.580 1.00 53.28 27 A 1 ATOM 216 C C . ILE A 0 27 . 8.302 3.669 -13.645 1.00 53.28 27 A 1 ATOM 217 C CB . ILE A 0 27 . 8.096 4.302 -11.161 1.00 53.28 27 A 1 ATOM 218 O O . ILE A 0 27 . 8.961 2.665 -13.413 1.00 53.28 27 A 1 ATOM 219 C CG1 . ILE A 0 27 . 7.383 5.279 -10.211 1.00 53.28 27 A 1 ATOM 220 C CG2 . ILE A 0 27 . 9.589 4.707 -11.146 1.00 53.28 27 A 1 ATOM 221 C CD1 . ILE A 0 27 . 7.765 5.095 -8.732 1.00 53.28 27 A 1 ATOM 222 N N . GLU A 0 28 . 8.237 4.234 -14.844 1.00 55.67 28 A 1 ATOM 223 C CA . GLU A 0 28 . 9.443 4.711 -15.490 1.00 55.67 28 A 1 ATOM 224 C C . GLU A 0 28 . 10.561 3.646 -15.621 1.00 55.67 28 A 1 ATOM 225 C CB . GLU A 0 28 . 9.777 6.076 -14.835 1.00 55.67 28 A 1 ATOM 226 O O . GLU A 0 28 . 11.702 3.821 -15.188 1.00 55.67 28 A 1 ATOM 227 C CG . GLU A 0 28 . 11.114 6.727 -15.169 1.00 55.67 28 A 1 ATOM 228 C CD . GLU A 0 28 . 11.076 8.254 -15.060 1.00 55.67 28 A 1 ATOM 229 O OE1 . GLU A 0 28 . 11.078 8.921 -16.117 1.00 55.67 28 A 1 ATOM 230 O OE2 . GLU A 0 28 . 11.113 8.755 -13.919 1.00 55.67 28 A 1 ATOM 231 N N . ASP A 0 29 . 10.294 2.641 -16.467 1.00 55.29 29 A 1 ATOM 232 C CA . ASP A 0 29 . 11.318 2.079 -17.378 1.00 55.29 29 A 1 ATOM 233 C C . ASP A 0 29 . 12.081 3.199 -18.144 1.00 55.29 29 A 1 ATOM 234 C CB . ASP A 0 29 . 10.653 1.120 -18.389 1.00 55.29 29 A 1 ATOM 235 O O . ASP A 0 29 . 13.189 3.018 -18.653 1.00 55.29 29 A 1 ATOM 236 C CG . ASP A 0 29 . 10.355 -0.285 -17.848 1.00 55.29 29 A 1 ATOM 237 O OD1 . ASP A 0 29 . 11.101 -0.745 -16.955 1.00 55.29 29 A 1 ATOM 238 O OD2 . ASP A 0 29 . 9.427 -0.917 -18.400 1.00 55.29 29 A 1 ATOM 239 N N . THR A 0 30 . 11.535 4.416 -18.142 1.00 57.80 30 A 1 ATOM 240 C CA . THR A 0 30 . 12.131 5.684 -18.580 1.00 57.80 30 A 1 ATOM 241 C C . THR A 0 30 . 13.389 6.127 -17.785 1.00 57.80 30 A 1 ATOM 242 C CB . THR A 0 30 . 10.979 6.713 -18.606 1.00 57.80 30 A 1 ATOM 243 O O . THR A 0 30 . 14.101 7.046 -18.208 1.00 57.80 30 A 1 ATOM 244 C CG2 . THR A 0 30 . 10.237 6.670 -19.932 1.00 57.80 30 A 1 ATOM 245 O OG1 . THR A 0 30 . 11.396 8.019 -18.451 1.00 57.80 30 A 1 ATOM 246 N N . SER A 0 31 . 13.808 5.411 -16.723 1.00 58.58 31 A 1 ATOM 247 C CA . SER A 0 31 . 15.157 5.602 -16.146 1.00 58.58 31 A 1 ATOM 248 C C . SER A 0 31 . 16.282 5.447 -17.189 1.00 58.58 31 A 1 ATOM 249 C CB . SER A 0 31 . 15.403 4.665 -14.957 1.00 58.58 31 A 1 ATOM 250 O O . SER A 0 31 . 17.379 5.993 -17.012 1.00 58.58 31 A 1 ATOM 251 O OG . SER A 0 31 . 15.535 3.317 -15.362 1.00 58.58 31 A 1 ATOM 252 N N . SER A 0 32 . 16.000 4.759 -18.301 1.00 56.50 32 A 1 ATOM 253 C CA . SER A 0 32 . 16.927 4.563 -19.412 1.00 56.50 32 A 1 ATOM 254 C C . SER A 0 32 . 16.955 5.713 -20.435 1.00 56.50 32 A 1 ATOM 255 C CB . SER A 0 32 . 16.667 3.194 -20.049 1.00 56.50 32 A 1 ATOM 256 O O . SER A 0 32 . 18.044 6.061 -20.901 1.00 56.50 32 A 1 ATOM 257 O OG . SER A 0 32 . 15.333 3.030 -20.480 1.00 56.50 32 A 1 ATOM 258 N N . ASP A 0 33 . 15.840 6.403 -20.700 1.00 55.51 33 A 1 ATOM 259 C CA . ASP A 0 33 . 15.785 7.394 -21.786 1.00 55.51 33 A 1 ATOM 260 C C . ASP A 0 33 . 16.081 8.835 -21.347 1.00 55.51 33 A 1 ATOM 261 C CB . ASP A 0 33 . 14.464 7.270 -22.558 1.00 55.51 33 A 1 ATOM 262 O O . ASP A 0 33 . 16.590 9.621 -22.146 1.00 55.51 33 A 1 ATOM 263 C CG . ASP A 0 33 . 14.407 6.021 -23.452 1.00 55.51 33 A 1 ATOM 264 O OD1 . ASP A 0 33 . 15.489 5.504 -23.818 1.00 55.51 33 A 1 ATOM 265 O OD2 . ASP A 0 33 . 13.275 5.637 -23.810 1.00 55.51 33 A 1 ATOM 266 N N . HIS A 0 34 . 15.900 9.217 -20.077 1.00 55.87 34 A 1 ATOM 267 C CA . HIS A 0 34 . 16.176 10.605 -19.664 1.00 55.87 34 A 1 ATOM 268 C C . HIS A 0 34 . 17.639 10.885 -19.308 1.00 55.87 34 A 1 ATOM 269 C CB . HIS A 0 34 . 15.198 11.032 -18.571 1.00 55.87 34 A 1 ATOM 270 O O . HIS A 0 34 . 18.155 11.963 -19.615 1.00 55.87 34 A 1 ATOM 271 C CG . HIS A 0 34 . 13.813 11.236 -19.127 1.00 55.87 34 A 1 ATOM 272 C CD2 . HIS A 0 34 . 12.637 10.798 -18.581 1.00 55.87 34 A 1 ATOM 273 N ND1 . HIS A 0 34 . 13.496 11.886 -20.303 1.00 55.87 34 A 1 ATOM 274 C CE1 . HIS A 0 34 . 12.166 11.830 -20.463 1.00 55.87 34 A 1 ATOM 275 N NE2 . HIS A 0 34 . 11.601 11.203 -19.431 1.00 55.87 34 A 1 ATOM 276 N N . ARG A 0 35 . 18.371 9.914 -18.750 1.00 57.58 35 A 1 ATOM 277 C CA . ARG A 0 35 . 19.832 10.064 -18.581 1.00 57.58 35 A 1 ATOM 278 C C . ARG A 0 35 . 20.565 9.936 -19.923 1.00 57.58 35 A 1 ATOM 279 C CB . ARG A 0 35 . 20.373 9.098 -17.515 1.00 57.58 35 A 1 ATOM 280 O O . ARG A 0 35 . 21.631 10.531 -20.083 1.00 57.58 35 A 1 ATOM 281 C CG . ARG A 0 35 . 19.679 9.291 -16.154 1.00 57.58 35 A 1 ATOM 282 C CD . ARG A 0 35 . 20.317 8.440 -15.048 1.00 57.58 35 A 1 ATOM 283 N NE . ARG A 0 35 . 21.391 9.159 -14.324 1.00 57.58 35 A 1 ATOM 284 N NH1 . ARG A 0 35 . 22.256 7.339 -13.227 1.00 57.58 35 A 1 ATOM 285 N NH2 . ARG A 0 35 . 23.015 9.382 -12.737 1.00 57.58 35 A 1 ATOM 286 C CZ . ARG A 0 35 . 22.215 8.626 -13.439 1.00 57.58 35 A 1 ATOM 287 N N . GLY A 0 36 . 19.984 9.206 -20.880 1.00 53.38 36 A 1 ATOM 288 C CA . GLY A 0 36 . 20.445 9.118 -22.268 1.00 53.38 36 A 1 ATOM 289 C C . GLY A 0 36 . 20.149 10.380 -23.085 1.00 53.38 36 A 1 ATOM 290 O O . GLY A 0 36 . 21.049 10.895 -23.742 1.00 53.38 36 A 1 ATOM 291 N N . ALA A 0 37 . 18.943 10.949 -22.981 1.00 58.83 37 A 1 ATOM 292 C CA . ALA A 0 37 . 18.552 12.160 -23.710 1.00 58.83 37 A 1 ATOM 293 C C . ALA A 0 37 . 19.356 13.399 -23.289 1.00 58.83 37 A 1 ATOM 294 C CB . ALA A 0 37 . 17.050 12.396 -23.519 1.00 58.83 37 A 1 ATOM 295 O O . ALA A 0 37 . 19.756 14.193 -24.140 1.00 58.83 37 A 1 ATOM 296 N N . VAL A 0 38 . 19.672 13.542 -21.994 1.00 58.13 38 A 1 ATOM 297 C CA . VAL A 0 38 . 20.565 14.617 -21.523 1.00 58.13 38 A 1 ATOM 298 C C . VAL A 0 38 . 21.964 14.471 -22.132 1.00 58.13 38 A 1 ATOM 299 C CB . VAL A 0 38 . 20.615 14.673 -19.983 1.00 58.13 38 A 1 ATOM 300 O O . VAL A 0 38 . 22.572 15.471 -22.500 1.00 58.13 38 A 1 ATOM 301 C CG1 . VAL A 0 38 . 21.639 15.690 -19.458 1.00 58.13 38 A 1 ATOM 302 C CG2 . VAL A 0 38 . 19.252 15.091 -19.416 1.00 58.13 38 A 1 ATOM 303 N N . ARG A 0 39 . 22.451 13.238 -22.319 1.00 63.54 39 A 1 ATOM 304 C CA . ARG A 0 39 . 23.736 12.972 -22.988 1.00 63.54 39 A 1 ATOM 305 C C . ARG A 0 39 . 23.678 13.095 -24.511 1.00 63.54 39 A 1 ATOM 306 C CB . ARG A 0 39 . 24.264 11.597 -22.569 1.00 63.54 39 A 1 ATOM 307 O O . ARG A 0 39 . 24.709 13.348 -25.121 1.00 63.54 39 A 1 ATOM 308 C CG . ARG A 0 39 . 24.753 11.634 -21.120 1.00 63.54 39 A 1 ATOM 309 C CD . ARG A 0 39 . 25.297 10.269 -20.709 1.00 63.54 39 A 1 ATOM 310 N NE . ARG A 0 39 . 26.089 10.384 -19.470 1.00 63.54 39 A 1 ATOM 311 N NH1 . ARG A 0 39 . 25.671 8.292 -18.632 1.00 63.54 39 A 1 ATOM 312 N NH2 . ARG A 0 39 . 27.044 9.677 -17.536 1.00 63.54 39 A 1 ATOM 313 C CZ . ARG A 0 39 . 26.260 9.453 -18.554 1.00 63.54 39 A 1 ATOM 314 N N . MET A 0 40 . 22.507 12.958 -25.130 1.00 57.76 40 A 1 ATOM 315 C CA . MET A 0 40 . 22.354 13.158 -26.574 1.00 57.76 40 A 1 ATOM 316 C C . MET A 0 40 . 22.324 14.630 -26.991 1.00 57.76 40 A 1 ATOM 317 C CB . MET A 0 40 . 21.119 12.418 -27.107 1.00 57.76 40 A 1 ATOM 318 O O . MET A 0 40 . 22.573 14.916 -28.159 1.00 57.76 40 A 1 ATOM 319 C CG . MET A 0 40 . 21.445 10.961 -27.438 1.00 57.76 40 A 1 ATOM 320 S SD . MET A 0 40 . 20.212 10.197 -28.522 1.00 57.76 40 A 1 ATOM 321 C CE . MET A 0 40 . 21.155 8.767 -29.110 1.00 57.76 40 A 1 ATOM 322 N N . ARG A 0 41 . 22.079 15.578 -26.074 1.00 73.52 41 A 1 ATOM 323 C CA . ARG A 0 41 . 22.112 17.006 -26.431 1.00 73.52 41 A 1 ATOM 324 C C . ARG A 0 41 . 23.524 17.504 -26.741 1.00 73.52 41 A 1 ATOM 325 C CB . ARG A 0 41 . 21.415 17.851 -25.359 1.00 73.52 41 A 1 ATOM 326 O O . ARG A 0 41 . 23.690 18.268 -27.685 1.00 73.52 41 A 1 ATOM 327 C CG . ARG A 0 41 . 21.197 19.276 -25.894 1.00 73.52 41 A 1 ATOM 328 C CD . ARG A 0 41 . 20.248 20.095 -25.020 1.00 73.52 41 A 1 ATOM 329 N NE . ARG A 0 41 . 20.891 20.538 -23.771 1.00 73.52 41 A 1 ATOM 330 N NH1 . ARG A 0 41 . 19.158 21.843 -23.024 1.00 73.52 41 A 1 ATOM 331 N NH2 . ARG A 0 41 . 21.060 21.739 -21.852 1.00 73.52 41 A 1 ATOM 332 C CZ . ARG A 0 41 . 20.368 21.368 -22.890 1.00 73.52 41 A 1 ATOM 333 N N . ASP A 0 42 . 24.528 17.036 -26.004 1.00 63.18 42 A 1 ATOM 334 C CA . ASP A 0 42 . 25.917 17.472 -26.207 1.00 63.18 42 A 1 ATOM 335 C C . ASP A 0 42 . 26.596 16.755 -27.392 1.00 63.18 42 A 1 ATOM 336 C CB . ASP A 0 42 . 26.715 17.297 -24.905 1.00 63.18 42 A 1 ATOM 337 O O . ASP A 0 42 . 27.672 17.155 -27.823 1.00 63.18 42 A 1 ATOM 338 C CG . ASP A 0 42 . 26.163 18.097 -23.713 1.00 63.18 42 A 1 ATOM 339 O OD1 . ASP A 0 42 . 25.426 19.092 -23.923 1.00 63.18 42 A 1 ATOM 340 O OD2 . ASP A 0 42 . 26.461 17.682 -22.570 1.00 63.18 42 A 1 ATOM 341 N N . GLY A 0 43 . 25.967 15.705 -27.935 1.00 59.67 43 A 1 ATOM 342 C CA . GLY A 0 43 . 26.462 14.957 -29.093 1.00 59.67 43 A 1 ATOM 343 C C . GLY A 0 43 . 25.972 15.470 -30.450 1.00 59.67 43 A 1 ATOM 344 O O . GLY A 0 43 . 26.295 14.857 -31.463 1.00 59.67 43 A 1 ATOM 345 N N . ASN A 0 44 . 25.180 16.546 -30.494 1.00 63.78 44 A 1 ATOM 346 C CA . ASN A 0 44 . 24.585 17.043 -31.734 1.00 63.78 44 A 1 ATOM 347 C C . ASN A 0 44 . 25.223 18.357 -32.220 1.00 63.78 44 A 1 ATOM 348 C CB . ASN A 0 44 . 23.054 17.054 -31.601 1.00 63.78 44 A 1 ATOM 349 O O . ASN A 0 44 . 24.536 19.375 -32.333 1.00 63.78 44 A 1 ATOM 350 C CG . ASN A 0 44 . 22.392 17.114 -32.965 1.00 63.78 44 A 1 ATOM 351 N ND2 . ASN A 0 44 . 22.075 18.288 -33.451 1.00 63.78 44 A 1 ATOM 352 O OD1 . ASN A 0 44 . 22.185 16.117 -33.632 1.00 63.78 44 A 1 ATOM 353 N N . SER A 0 45 . 26.527 18.294 -32.521 1.00 54.16 45 A 1 ATOM 354 C CA . SER A 0 45 . 27.215 18.983 -33.634 1.00 54.16 45 A 1 ATOM 355 C C . SER A 0 45 . 28.664 18.515 -33.738 1.00 54.16 45 A 1 ATOM 356 C CB . SER A 0 45 . 27.178 20.509 -33.523 1.00 54.16 45 A 1 ATOM 357 O O . SER A 0 45 . 29.398 18.734 -32.748 1.00 54.16 45 A 1 ATOM 358 O OG . SER A 0 45 . 27.884 20.901 -32.373 1.00 54.16 45 A 1 ATOM 359 O OXT . SER A 0 45 . 28.995 17.979 -34.813 1.00 54.16 45 A 1 # _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.3.9 _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic # loop_ _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.details _pdbx_data_usage.url _pdbx_data_usage.name 1 license 'Data in this file is available under a CC-BY-4.0 license.' https://creativecommons.org/licenses/by/4.0/ CC-BY-4.0 2 disclaimer ;ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE INFORMATION PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD PARTY. DISCLAIMER: THE INFORMATION IS NOT INTENDED TO BE A SUBSTITUTE FOR PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES NOT CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE. ; ? ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Jumper, John' 1 'Evans, Richard' 2 'Pritzel, Alexander' 3 'Green, Tim' 4 'Figurnov, Michael' 5 'Ronneberger, Olaf' 6 'Tunyasuvunakool, Kathryn' 7 'Bates, Russ' 8 'Zidek, Augustin' 9 'Potapenko, Anna' 10 'Bridgland, Alex' 11 'Meyer, Clemens' 12 'Kohl, Simon A. A.' 13 'Ballard, Andrew J.' 14 'Cowie, Andrew' 15 'Romera-Paredes, Bernardino' 16 'Nikolov, Stanislav' 17 'Jain, Rishub' 18 'Adler, Jonas' 19 'Back, Trevor' 20 'Petersen, Stig' 21 'Reiman, David' 22 'Clancy, Ellen' 23 'Zielinski, Michal' 24 'Steinegger, Martin' 25 'Pacholska, Michalina' 26 'Berghammer, Tamas' 27 'Silver, David' 28 'Vinyals, Oriol' 29 'Senior, Andrew W.' 30 'Kavukcuoglu, Koray' 31 'Kohli, Pushmeet' 32 'Hassabis, Demis' 33 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Jumper, John' 1 primary 'Evans, Richard' 2 primary 'Pritzel, Alexander' 3 primary 'Green, Tim' 4 primary 'Figurnov, Michael' 5 primary 'Ronneberger, Olaf' 6 primary 'Tunyasuvunakool, Kathryn' 7 primary 'Bates, Russ' 8 primary 'Zidek, Augustin' 9 primary 'Potapenko, Anna' 10 primary 'Bridgland, Alex' 11 primary 'Meyer, Clemens' 12 primary 'Kohl, Simon A. A.' 13 primary 'Ballard, Andrew J.' 14 primary 'Cowie, Andrew' 15 primary 'Romera-Paredes, Bernardino' 16 primary 'Nikolov, Stanislav' 17 primary 'Jain, Rishub' 18 primary 'Adler, Jonas' 19 primary 'Back, Trevor' 20 primary 'Petersen, Stig' 21 primary 'Reiman, David' 22 primary 'Clancy, Ellen' 23 primary 'Zielinski, Michal' 24 primary 'Steinegger, Martin' 25 primary 'Pacholska, Michalina' 26 primary 'Berghammer, Tamas' 27 primary 'Silver, David' 28 primary 'Vinyals, Oriol' 29 primary 'Senior, Andrew W.' 30 primary 'Kavukcuoglu, Koray' 31 primary 'Kohli, Pushmeet' 32 primary 'Hassabis, Demis' 33 # _citation.id primary _citation.title 'Highly accurate protein structure prediction with AlphaFold' _citation.journal_full Nature _citation.journal_volume 596 _citation.page_first 583 _citation.page_last 589 _citation.year 2021 _citation.journal_id_ASTM NATUAS _citation.country UK _citation.journal_id_ISSN 0028-0836 _citation.journal_id_CSD 0006 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 34265844 _citation.pdbx_database_id_DOI 10.1038/s41586-021-03819-2 # _ma_data.id 1 _ma_data.name Model _ma_data.content_type 'model coordinates' # _ma_target_entity_instance.asym_id A _ma_target_entity_instance.entity_id 0 _ma_target_entity_instance.details . # _ma_target_entity.entity_id 0 _ma_target_entity.data_id 1 _ma_target_entity.origin . # _ma_model_list.ordinal_id 1 _ma_model_list.model_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_name 'Top ranked model' _ma_model_list.model_group_name 'AlphaFold Monomer v2.3.2 model' _ma_model_list.data_id 1 _ma_model_list.model_type 'Ab initio model' # _software.pdbx_ordinal 1 _software.name AlphaFold _software.version v2.3.2 _software.type package _software.description 'Structure prediction' _software.classification other _software.date ? # _ma_software_group.ordinal_id 1 _ma_software_group.group_id 1 _ma_software_group.software_id 1 # loop_ _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id _ma_protocol_step.method_type 1 1 1 'coevolution MSA' 2 1 2 'template search' 3 1 3 modeling # loop_ _ma_qa_metric.id _ma_qa_metric.name _ma_qa_metric.type _ma_qa_metric.mode _ma_qa_metric.software_group_id 1 pLDDT pLDDT global 1 2 pLDDT pLDDT local 1 # _ma_qa_metric_global.ordinal_id 1 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 70.73 # loop_ _atom_type.symbol C N O S #