Structure of PDB 7moa Chain D Binding Site BS02 |
>7moa Chain D (length=638) Species: 9606 (Homo sapiens)
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KRRNTIHEFKKSAKTTLIKIDPIKTKKVNTADQCANRCTRNKGLPFTCKA FVFDKARKQCLWFPFNSMSSGVKKEFGHEFDLYENKDYIRNCIIGKGRSY KGTVSITKSGIKCQPWSSMIPHEHSFLPSSYRGKDLQENYCRNPRGEEGG PWCFTSNPEVRYEVCDIPQCSEVECMTCNGESYRGLMDHTESGKICQRWD HQTPHRHKFLPERYPDKGFDDNYCRNPDGQPRPWCYTLDPHTRWEYCAIK TCTECIQGQGEGYRGTVNTIWNGIPCQRWDSQYPHEHDMTPENFKCKDLR ENYCRNPDGSESPWCFTTDPNIRVGYCSQIPNCQDCYRGNGKNYMGNLSQ TRSGLTCSMWDKNMEDLHRHIFWEKLNENYCRNPDDDAHGPWCYTGNPLI PWDYCPISRCVVNGIPTRTNIGWMVSLRYRNKHICGGSLIKESWVLTARQ CFPSRDLKDYEAWLGIHDVHGRGDEKCKQVLNVSQLVYGPEGSDLVLMKL ARPAVLDDFVSTIDLPNYGCTIPEKTSCSVYGWGYTGLINYDGLLRVAHL YIMGNEKCSQHHRGKVTLNESEICAGAEKIGSGPCEGDYGGPLVCEQHKM RMVLGVIVPGRGCAIPNRPGIFVRVAYYAKWIHKIILT |
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Ligand ID | IDS |
InChI | InChI=1S/C6H10O10S/c7-1-2(8)4(16-17(12,13)14)6(11)15-3(1)5(9)10/h1-4,6-8,11H,(H,9,10)(H,12,13,14)/t1-,2-,3+,4+,6+/m0/s1 |
InChIKey | COJBCAMFZDFGFK-VCSGLWQLSA-N |
SMILES | Software | SMILES |
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OpenEye OEToolkits 1.5.0 | C1(C(C(OC(C1OS(=O)(=O)O)O)C(=O)O)O)O | OpenEye OEToolkits 1.5.0 | [C@@H]1([C@@H]([C@@H](O[C@H]([C@@H]1OS(=O)(=O)O)O)C(=O)O)O)O | CACTVS 3.341 | O[CH]1O[CH]([CH](O)[CH](O)[CH]1O[S](O)(=O)=O)C(O)=O | CACTVS 3.341 | O[C@@H]1O[C@H]([C@@H](O)[C@H](O)[C@H]1O[S](O)(=O)=O)C(O)=O | ACDLabs 10.04 | O=S(=O)(OC1C(O)C(O)C(OC1O)C(=O)O)O |
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Formula | C6 H10 O10 S |
Name | 2-O-sulfo-alpha-L-idopyranuronic acid; O2-SULFO-GLUCURONIC ACID; 2-O-sulfo-alpha-L-iduronic acid; 2-O-sulfo-L-iduronic acid; 2-O-sulfo-iduronic acid |
ChEMBL | |
DrugBank | DB02264 |
ZINC | ZINC000004096028
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PDB chain | 7moa Chain J Residue 2
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