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Target
Dihydrofolate reductase
Ligand
BDBM50130950
Substrate
n/a
Meas. Tech.
ChEMBL_54550 (CHEMBL664866)
Ki
61.0±n/a nM
Citation
 Zolli-Juran, M; Cechetto, JD; Hartlen, R; Daigle, DM; Brown, ED High throughput screening identifies novel inhibitors of Escherichia coli dihydrofolate reductase that are competitive with dihydrofolate. Bioorg Med Chem Lett 13:2493-6 (2003) [PubMed]  Article 
Target
Name:
Dihydrofolate reductase
Synonyms:
Dihydrofolate reductase (F31V) | dfrA17
Type:
n/a
Mol. Mass.:
17532.46
Organism:
Escherichia coli
Description:
n/a
Residue:
157
Sequence:
MKISLISAVSESGVIGSGPDIPWSVKGEQLLFKALTYNQWLLVGRKTFDSMGVLPNRKYAVVSKNGISSSNENVLVFPSIENALKELSKVTDHVYVSGGGQIYNSLIEKADIIHLSTVHVEVEGDIKFPIMPENFNLVFEQFFMSNINYTYQIWKKG
  
Inhibitor
Name:
BDBM50130950
Synonyms:
5-(4-Chloro-phenylsulfanyl)-quinazoline-2,4-diamine | 5-[(4-chlorophenyl)sulfanyl]quinazoline-2,4-diamine | 5-[(4-chlorophenyl)sulfanyl]quinazoline-2,4-diamine, 2d | CHEMBL310759
Type:
Small organic molecule
Emp. Form.:
C14H11ClN4S
Mol. Mass.:
302.782
SMILES:
Nc1nc(N)c2c(Sc3ccc(Cl)cc3)cccc2n1
Structure:
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