Reaction Details |
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Target | 3-dehydroquinate dehydratase |
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Ligand | BDBM50137053 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_213120 (CHEMBL818199) |
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Ki | 70000±n/a nM |
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Citation | González-Bello, C; Lence, E; Toscano, MD; Castedo, L; Coggins, JR; Abell, C Parallel solid-phase synthesis and evaluation of inhibitors of Streptomyces coelicolor type II dehydroquinase. J Med Chem46:5735-44 (2003) [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_STRCO | aroQ |
Type: | PROTEIN |
Mol. Mass.: | 16681.13 |
Organism: | Streptomyces coelicolor |
Description: | ChEMBL_332877 |
Residue: | 157 |
Sequence: | MPRSLANAPIMILNGPNLNLLGQRQPEIYGSDTLADVEALCVKAAAAHGGTVDFRQSNHE
GELVDWIHEARLNHCGIVINPAAYSHTSVAILDALNTCDGLPVVEVHISNIHQREPFRHH
SYVSQRADGVVAGCGVQGYVFGVERIAALAGAGSARA
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BDBM50137053 |
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n/a |
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Name | BDBM50137053 |
Synonyms: | (1R,4R,5R)-4-(4-Fluoro-benzyloxy)-1,5-dihydroxy-cyclohex-2-enecarboxylic acid | CHEMBL154048 |
Type | Small organic molecule |
Emp. Form. | C14H15FO5 |
Mol. Mass. | 282.2643 |
SMILES | O[C@@H]1C[C@@](O)(C=C[C@H]1OCc1ccc(F)cc1)C(O)=O |c:5| |
Structure |
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