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Target
3-dehydroquinate dehydratase
Ligand
BDBM50137064
Substrate
n/a
Meas. Tech.
ChEMBL_213120 (CHEMBL818199)
Ki
1330000±n/a nM
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 Chem 46:5735-44 (2003) [PubMed]  Article 
Target
Name:
3-dehydroquinate dehydratase
Synonyms:
AROQ_STRCO | aroQ
Type:
PROTEIN
Mol. Mass.:
16681.13
Organism:
Streptomyces coelicolor
Description:
ChEMBL_332877
Residue:
157
Sequence:
MPRSLANAPIMILNGPNLNLLGQRQPEIYGSDTLADVEALCVKAAAAHGGTVDFRQSNHEGELVDWIHEARLNHCGIVINPAAYSHTSVAILDALNTCDGLPVVEVHISNIHQREPFRHHSYVSQRADGVVAGCGVQGYVFGVERIAALAGAGSARA
  
Inhibitor
Name:
BDBM50137064
Synonyms:
(1R,4R,5R)-4,5-Dihydroxy-1-(4-hydroxymethyl-benzyloxy)-cyclohex-2-enecarboxylic acid | CHEMBL157279
Type:
Small organic molecule
Emp. Form.:
C15H18O6
Mol. Mass.:
294.2998
SMILES:
OCc1ccc(CO[C@@]2(C[C@@H](O)[C@H](O)C=C2)C(O)=O)cc1 |c:14|
Structure:
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