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Target
Dihydrofolate reductase
Ligand
BDBM50120979
Substrate
n/a
Meas. Tech.
ChEMBL_54739 (CHEMBL667190)
IC50
900±n/a nM
Citation
 Gangjee, A; Zeng, Y; McGuire, JJ; Kisliuk, RL Synthesis of classical and nonclassical, partially restricted, linear, tricyclic 5-deaza antifolates. J Med Chem 45:5173-81 (2002) [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:
BDBM50120979
Synonyms:
2-[4-(2,4-Diamino-7,8-dihydro-5H-1,3,6,9-tetraaza-anthracen-6-ylmethyl)-benzoylamino]-pentanedioic acid | CHEMBL422316
Type:
Small organic molecule
Emp. Form.:
C23H25N7O5
Mol. Mass.:
479.4885
SMILES:
Nc1nc(N)c2cc3CN(Cc4ccc(cc4)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc3nc2n1
Structure:
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