| Reaction Details |
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 | Report a problem with these data |
| Target | Steroid Delta-isomerase |
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| Ligand | BDBM50292538 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_941591 (CHEMBL2330673) |
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| Kd | 180000±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 |
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| Synonyms: | Delta(5)-3-ketosteroid isomerase | SDIS_PSEPU | ksi |
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| Type: | PROTEIN |
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| Mol. Mass.: | 14529.85 |
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| Organism: | Pseudomonas putida |
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| Description: | ChEMBL_941591 |
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| Residue: | 131 |
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| Sequence: | MNLPTAQEVQGLMARYIELVDVGDIEAIVQMYADDATVEDPFGQPPIHGREQIAAFYRQG
LGGGKVRACLTGPVRASHNGCGAMPFRVEMVWNGQPCALDVIDVMRFDEHGRIQTMQAYW
SEVNLSVREPQ
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|
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| BDBM50292538 |
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| n/a |
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| Name | BDBM50292538 |
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| Synonyms: | (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-ol | CHEMBL310934 | eseroline |
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| Type | Small organic molecule |
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| Emp. Form. | C13H18N2O |
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| Mol. Mass. | 218.2948 |
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| SMILES | CN1CC[C@]2(C)[C@H]1N(C)c1ccc(O)cc21 |r| |
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| Structure | 
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