Reaction Details Report a problem with these data
Target
Cystathionine beta-lyase MetC
Ligand
BDBM50370860
Substrate
n/a
Meas. Tech.
ChEMBL_425863 (CHEMBL856866)
IC50
79±n/a nM
Citation
 Ejim, LJ; Blanchard, JE; Koteva, KP; Sumerfield, R; Elowe, NH; Chechetto, JD; Brown, ED; Junop, MS; Wright, GD Inhibitors of bacterial cystathionine beta-lyase: leads for new antimicrobial agents and probes of enzyme structure and function. J Med Chem 50:755-64 (2007) [PubMed]  Article 
Target
Name:
Cystathionine beta-lyase MetC
Synonyms:
Beta-cystathionase | Cysteine lyase | CBL | METC_ECOLI | metC
Type:
PROTEIN
Mol. Mass.:
43211.38
Organism:
Escherichia coli (strain K12)
Description:
ChEMBL_425863
Residue:
395
Sequence:
MADKKLDTQLVNAGRSKKYTLGAVNSVIQRASSLVFDSVEAKKHATRNRANGELFYGRRGTLTHFSLQQAMCELEGGAGCVLFPCGAAAVANSILAFIEQGDHVLMTNTAYEPSQDFCSKILSKLGVTTSWFDPLIGADIVKHLQPNTKIVFLESPGSITMEVHDVPAIVAAVRSVVPDAIIMIDNTWAAGVLFKALDFGIDVSIQAATKYLVGHSDAMIGTAVCNARCWEQLRENAYLMGQMVDADTAYITSRGLRTLGVRLRQHHESSLKVAEWLAEHPQVARVNHPALPGSKGHEFWKRDFTGSSGLFSFVLKKKLNNEELANYLDNFSLFSMAYSWGGYESLILANQPEHIAAIRPQGEIDFSGTLIRLHIGLEDVDDLIADLDAGFARIV
  
Inhibitor
Name:
BDBM50370860
Synonyms:
CHEMBL219268
Type:
Small organic molecule
Emp. Form.:
C10H10F3N3O2
Mol. Mass.:
261.07
SMILES:
NNC(=O)CNC(=O)c1ccccc1C(F)(F)F
Structure:
Search PDB for entries with ligand similarity: