Reaction Details Report a problem with these data
Target
Phenylalanine--tRNA ligase alpha subunit
Ligand
BDBM50140714
Substrate
n/a
Meas. Tech.
ChEMBL_154869 (CHEMBL768843)
IC50
>100000±n/a nM
Citation
 Yu, XY; Finn, J; Hill, JM; Wang, ZG; Keith, D; Silverman, J; Oliver, N A series of spirocyclic analogues as potent inhibitors of bacterial phenylalanyl-tRNA synthetases. Bioorg Med Chem Lett 14:1339-42 (2004) [PubMed]  Article 
Target
Name:
Phenylalanine--tRNA ligase alpha subunit
Synonyms:
Phenylalanyl-tRNA synthetase alpha chain | SYFA_STRP8 | pheS
Type:
PROTEIN
Mol. Mass.:
39288.40
Organism:
Streptococcus pyogenes serotype M18
Description:
ChEMBL_154869
Residue:
347
Sequence:
MDLQAQLEELKTKTLETLQSLTGNHTKELQDLRVAVLGKKGSLTELLKGLKDLSNDLRPVVGKQVNEVRDLLTKAFEEQAKIVEAAKIQAQLDAESIDVTLPGRQMTLGHRHVLTQTSEEIEDIFLGMGFQIVDGFEVEKDYYNFERMNLPKDHPARDMQDTFYITEEILLRTHTSPVQARTLDQHDFSKGPLKMVSPGRVFRRDTDDATHSHQFHQIEGLVVGKNISMRDLKGTLEMIIKKMFGEERSIRLRPSYFPFTEPSVEVDVSCFKCGGKGCNVCKKTGWIEILGAGMVHPSVLEMSGVDAKEYSGFAFGLGQERIAMLRYGINDIRGFYQGDQRFSEQFN
  
Inhibitor
Name:
BDBM50140714
Synonyms:
CHEMBL27142 | methyl 5-(3,4-dichlorophenyl)-4,6-dioxo-3-phenyl-(3R,3aS,6aR)-perhydropyrrolo[3,4-c]pyrrole-1-carboxylate
Type:
Small organic molecule
Emp. Form.:
C20H16Cl2N2O4
Mol. Mass.:
419.258
SMILES:
COC(=O)C1NC(c2c(O)n(c(O)c12)-c1ccc(Cl)c(Cl)c1)c1ccccc1
Structure:
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