Target
3-dehydroquinate synthase
Ligand
BDBM50280172
Substrate
n/a
Meas. Tech.
ChEBML_358
KOFF
0.000750 s-1
KON
140000 M-1s-1
Citation
 Montchamp, JLPiehler, LTTolbert, TJFront, JW The basis for slowly reversible inhibition of dehydroquinate synthase: a case of mistaken identity? Bioorg Med Chem Lett 2:1349-1352 (1992)    Article 
Target
Name:
3-dehydroquinate synthase
Synonyms:
AROB_ECOLI | aroB
Type:
Enzyme
Mol. Mass.:
38878.02
Organism:
Escherichia coli (strain K12)
Description:
P07639
Residue:
362
Sequence:
MERIVVTLGERSYPITIASGLFNEPASFLPLKSGEQVMLVTNETLAPLYLDKVRGVLEQAGVNVDSVILPDGEQYKSLAVLDTVFTALLQKPHGRDTTLVALGGGVVGDLTGFAAASYQRGVRFIQVPTTLLSQVDSSVGGKTAVNHPLGKNMIGAFYQPASVVVDLDCLKTLPPRELASGLAEVIKYGIILDGAFFNWLEENLDALLRLDGPAMAYCIRRCCELKAEVVAADERETGLRALLNLGHTFGHAIEAEMGYGNWLHGEAVAAGMVMAARTSERLGQFSSAETQRIITLLKRAGLPVNGPREMSAQAYLPHMLRDKKVLAGEMRLILPLAIGKSEVRSGVSHELVLNAIADCQSA
  
Inhibitor
Name:
BDBM50280172
Synonyms:
1,3,4-Trihydroxy-5-phosphonomethyl-cyclohexanecarboxylic acid | CHEMBL281425
Type:
Small organic molecule
Emp. Form.:
C8H15O8P
Mol. Mass.:
270.1737
SMILES:
OC1CC(O)(CC(CP(O)(O)=O)C1O)C(O)=O
Structure:
Search PDB for entries with ligand similarity: