Target
3-dehydroquinate dehydratase
Ligand
BDBM14672
Substrate
n/a
Meas. Tech.
ChEMBL_332877 (CHEMBL859230)
Kd
7300±n/a nM
Citation
 Robinson, DAStewart, KAPrice, NCChalk, PACoggins, JRLapthorn, AJ Crystal structures of Helicobacter pylori type II dehydroquinase inhibitor complexes: new directions for inhibitor design. J Med Chem 49:1282-90 (2006) [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:
BDBM14672
Synonyms:
2-hydroxypropane-1,2,3-tricarboxylic acid | CHEMBL1261 | Citrate | Citric Acid | Fragment 2 | cid_311
Type:
Small organic molecule
Emp. Form.:
C6H8O7
Mol. Mass.:
192.1235
SMILES:
OC(=O)CC(O)(CC(O)=O)C(O)=O
Structure:
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