Target
3-phosphoshikimate 1-carboxyvinyltransferase
Ligand
BDBM50403586
Substrate
n/a
Meas. Tech.
ChEBML_64947
Ki
1300±n/a nM
Citation
 Peterson, MLCorey, SDFont, JLWalker, MCSikorski, JA New simplified inhibitors of EPSP synthase: The importance of ring size for recognition at the shikimate 3-phosphate site Bioorg Med Chem Lett 6:2853-2858 (1996)    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:
BDBM50403586
Synonyms:
CHEMBL97331
Type:
Small organic molecule
Emp. Form.:
C12H11O13P
Mol. Mass.:
394.1817
SMILES:
OC(=O)C(Oc1cc(OC(C(O)=O)P(O)(O)=O)cc(c1)C(O)=O)C(O)=O
Structure:
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