Reaction Details |
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Target | 3-dehydroquinate synthase |
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Ligand | BDBM50100862 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_350 (CHEMBL615323) |
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Ki | 5000±n/a nM |
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Citation | Chandran, SS; Frost, JW Aromatic inhibitors of dehydroquinate synthase: synthesis, evaluation and implications for gallic acid biosynthesis. Bioorg Med Chem Lett11:1493-6 (2001) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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3-dehydroquinate synthase |
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Name: | 3-dehydroquinate synthase |
Synonyms: | AROB_ECOLI | aroB |
Type: | Enzyme |
Mol. Mass.: | 38878.02 |
Organism: | Escherichia coli (strain K12) |
Description: | P07639 |
Residue: | 362 |
Sequence: | MERIVVTLGERSYPITIASGLFNEPASFLPLKSGEQVMLVTNETLAPLYLDKVRGVLEQA
GVNVDSVILPDGEQYKSLAVLDTVFTALLQKPHGRDTTLVALGGGVVGDLTGFAAASYQR
GVRFIQVPTTLLSQVDSSVGGKTAVNHPLGKNMIGAFYQPASVVVDLDCLKTLPPRELAS
GLAEVIKYGIILDGAFFNWLEENLDALLRLDGPAMAYCIRRCCELKAEVVAADERETGLR
ALLNLGHTFGHAIEAEMGYGNWLHGEAVAAGMVMAARTSERLGQFSSAETQRIITLLKRA
GLPVNGPREMSAQAYLPHMLRDKKVLAGEMRLILPLAIGKSEVRSGVSHELVLNAIADCQ
SA
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BDBM50100862 |
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n/a |
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Name | BDBM50100862 |
Synonyms: | 3,4-Dihydroxy-5-(2-phosphono-ethyl)-benzoic acid | CHEMBL285952 |
Type | Small organic molecule |
Emp. Form. | C9H11O7P |
Mol. Mass. | 262.1532 |
SMILES | OC(=O)c1cc(O)c(O)c(CCP(O)(O)=O)c1 |
Structure |
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