Target
3-phosphoshikimate 1-carboxyvinyltransferase
Ligand
BDBM50281988
Substrate
n/a
Meas. Tech.
ChEMBL_64960 (CHEMBL676326)
Kd
7000±n/a nM
Citation
 Miller, MJAnderson, KSBraccolino, DSCleary, DGGruys, KJHan, CYLin, KCPansegrau, PDReam, JESammons, RDSikorski, JA EPSP synthase inhibitor design II. The importance of the 3-phosphate group for ligand binding at the shikimate-3-phosphate site & the identification of 3-malonate ethers as novel 3-phosphate mimics. Bioorg Med Chem Lett 3:1435-1440 (1993)    Article 
Target
Name:
3-phosphoshikimate 1-carboxyvinyltransferase
Synonyms:
5-enolpyruvylshikimate-3-phosphate synthase | AROA_ECOLI | aroA
Type:
PROTEIN
Mol. Mass.:
46089.22
Organism:
Escherichia coli (strain K12)
Description:
ChEMBL_65087
Residue:
427
Sequence:
MESLTLQPIARVDGTINLPGSKSVSNRALLLAALAHGKTVLTNLLDSDDVRHMLNALTALGVSYTLSADRTRCEIIGNGGPLHAEGALELFLGNAGTAMRPLAAALCLGSNDIVLTGEPRMKERPIGHLVDALRLGGAKITYLEQENYPPLRLQGGFTGGNVDVDGSVSSQFLTALLMTAPLAPEDTVIRIKGDLVSKPYIDITLNLMKTFGVEIENQHYQQFVVKGGQSYQSPGTYLVEGDASSASYFLAAAAIKGGTVKVTGIGRNSMQGDIRFADVLEKMGATICWGDDYISCTRGELNAIDMDMNHIPDAAMTIATAALFAKGTTTLRNIYNWRVKETDRLFAMATELRKVGAEVEEGHDYIRITPPEKLNFAEIATYNDHRMAMCFSLVALSDTPVTILDPKCTAKTFPDYFEQLARISQAA
  
Inhibitor
Name:
BDBM50281988
Synonyms:
CHEMBL32352 | Sodium salt of (3R,4S,5R)-4,5-Dihydroxy-3-phosphonooxy-cyclohex-1-enecarboxylic acid
Type:
Small organic molecule
Emp. Form.:
C7H10O8P
Mol. Mass.:
253.1238
SMILES:
O[C@@H]1CC(=C[C@@H](OP(O)([O-])=O)[C@H]1O)C(O)=O |c:3|
Structure:
Search PDB for entries with ligand similarity: