Reaction Details |
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Target | Steroid Delta-isomerase |
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Ligand | BDBM50375599 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_941591 (CHEMBL2330673) |
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Kd | 16000±n/a nM |
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Citation | Kobe, A; Caaveiro, JM; Tashiro, S; Kajihara, D; Kikkawa, M; Mitani, T; Tsumoto, K Incorporation of rapid thermodynamic data in fragment-based drug discovery. J Med Chem56:2155-9 (2013) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Steroid Delta-isomerase |
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Name: | Steroid Delta-isomerase |
Synonyms: | Delta(5)-3-ketosteroid isomerase | SDIS_PSEPU | ksi |
Type: | PROTEIN |
Mol. Mass.: | 14529.85 |
Organism: | Pseudomonas putida |
Description: | ChEMBL_941591 |
Residue: | 131 |
Sequence: | MNLPTAQEVQGLMARYIELVDVGDIEAIVQMYADDATVEDPFGQPPIHGREQIAAFYRQG
LGGGKVRACLTGPVRASHNGCGAMPFRVEMVWNGQPCALDVIDVMRFDEHGRIQTMQAYW
SEVNLSVREPQ
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BDBM50375599 |
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n/a |
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Name | BDBM50375599 |
Synonyms: | DEOXYCHOLATE | Deoxycholic Acid | KYBELLA |
Type | Small organic molecule |
Emp. Form. | C24H40O4 |
Mol. Mass. | 392.572 |
SMILES | C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C |
Structure |
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