Reaction Details |
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Target | 3-dehydroquinate dehydratase |
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Ligand | BDBM50170810 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_303647 (CHEMBL828995) |
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pH | 8.2±n/a |
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Ki | 20000±n/a nM |
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Comments | extracted |
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Citation | Sánchez-Sixto, C; Prazeres, VF; Castedo, L; Lamb, H; Hawkins, AR; González-Bello, C Structure-based design, synthesis, and biological evaluation of inhibitors of Mycobacterium tuberculosis type II dehydroquinase. J Med Chem48:4871-81 (2005) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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3-dehydroquinate dehydratase |
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Name: | 3-dehydroquinate dehydratase |
Synonyms: | AROQ_MYCTU | aroD | aroQ |
Type: | PROTEIN |
Mol. Mass.: | 15786.25 |
Organism: | Mycobacterium tuberculosis |
Description: | ChEMBL_766423 |
Residue: | 147 |
Sequence: | MSELIVNVINGPNLGRLGRREPAVYGGTTHDELVALIEREAAELGLKAVVRQSDSEAQLL
DWIHQAADAAEPVILNAGGLTHTSVALRDACAELSAPLIEVHISNVHAREEFRRHSYLSP
IATGVIVGLGIQGYLLALRYLAEHVGT
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BDBM50170810 |
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n/a |
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Name | BDBM50170810 |
Synonyms: | (1S,3R,4R)-1,3,4-Trihydroxy-5-hydroxyimino-cyclohexanecarboxylic acid | 3-HYDROXYIMINO QUINIC ACID | CHEMBL363381 |
Type | Small organic molecule |
Emp. Form. | C7H11NO6 |
Mol. Mass. | 205.1653 |
SMILES | ONC1C[C@](O)(CC(=O)[C@@H]1O)C(O)=O |
Structure |
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