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P52209 | 6PGD_HUMAN | "6-phosphogluconate dehydrogenase, decarboxylating" (PGD)

3D structures mapped by conservation among orthologs

[ Domain: "6-phosphogluconate dehydrogenase C-terminal domain-like" // 6PGD ]

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[ Domain: "NAD(P)-binding Rossmann-fold domains" // NAD_binding_2 ]

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[ Domain: pdbs with more than 2 multi-domains ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL116018 OBDepict OH N H O HO H HO H O P O OH OH Ki = 10.0 nM 231.1 O=C(NO)[C@H](O)[C@H](O)COP(=O)(O)O Homo sapiens CHEMBL618442 assay format
CHEMBL324609 OBDepict HO N H O H O H O H 3 C CH 3 O P O HO OH Ki = 35.0 nM 271.16 CC1(C)O[C@H](COP(=O)(O)O)[C@H](C(=O)NO)O1 Homo sapiens CHEMBL618442 assay format
CHEMBL114269 OBDepict OH HN O O H O H O O CH 3 O H 3 C P O HO OH Ki = 80.0 nM 315.17 CC(=O)O[C@H](COP(=O)(O)O)[C@@H](OC(C)=O)C(=O)NO Homo sapiens CHEMBL618442 assay format
CHEMBL1160945 OBDepict OH O HO H HO H O P O OH OH Ki = 130.0 nM 216.08 O=C(O)[C@H](O)[C@H](O)COP(=O)(O)O Homo sapiens CHEMBL618442 assay format
CHEMBL36327 OBDepict HO OH O H H O O HO OH OH OH OH IC50 = 210.0 nM 442.38 O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1 Homo sapiens CHEMBL921930 single protein format
CHEMBL297453 OBDepict HO OH O H H O O OH HO OH OH OH OH IC50 = 720.0 nM 458.38 O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1 Homo sapiens CHEMBL921930 single protein format