| Reaction Details |
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 | Report a problem with these data |
| Target | Aldo-keto reductase family 1 member C1 |
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| Ligand | BDBM26269 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_741161 (CHEMBL1764483) |
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| Ki | 6.6±n/a nM |
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| Citation |  El-Kabbani, O; Dhagat, U; Soda, M; Endo, S; Matsunaga, T; Hara, A Probing the inhibitor selectivity pocket of human 20?-hydroxysteroid dehydrogenase (AKR1C1) with X-ray crystallography and site-directed mutagenesis. Bioorg Med Chem Lett21:2564-7 (2011) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Aldo-keto reductase family 1 member C1 |
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| Name: | Aldo-keto reductase family 1 member C1 |
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| Synonyms: | 20-alpha-HSD | 20-alpha-Hydroxysteroid Dehydrogenase (AKR1C1) | AK1C1_HUMAN | AKR1C1 | Aldo-keto reductase family 1 member C1 (AK1C1) | Aldo-keto reductase family 1 member C1 (AK1C1a) | Aldo-keto reductase family 1 member C1 (AKR1C1) | Chlordecone reductase homolog HAKRC | DDH | DDH1 | High-affinity hepatic bile acid-binding protein | Trans-1,2-dihydrobenzene-1,2-diol dehydrogenase |
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| Type: | Enzyme |
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| Mol. Mass.: | 36793.97 |
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| Organism: | Homo sapiens (Human) |
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| Description: | Recombinant AKR1C1 enzyme was expressed in E. coli. |
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| Residue: | 323 |
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| Sequence: | MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEATKLAIEAGFRHIDSAHLYNNEEQ
VGLAIRSKIADGSVKREDIFYTSKLWCNSHRPELVRPALERSLKNLQLDYVDLYLIHFPV
SVKPGEEVIPKDENGKILFDTVDLCATWEAVEKCKDAGLAKSIGVSNFNRRQLEMILNKP
GLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPV
LCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLN
RNVRYLTLDIFAGPPNYPFSDEY
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| BDBM26269 |
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| n/a |
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| Name | BDBM26269 |
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| Synonyms: | 3,5-dichloro-2-hydroxybenzoic acid | 3,5-dichlorosalicylic acid | CHEMBL449129 |
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| Type | Small organic molecule |
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| Emp. Form. | C7H4Cl2O3 |
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| Mol. Mass. | 207.011 |
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| SMILES | OC(=O)c1cc(Cl)cc(Cl)c1O |
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| Structure | 
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