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TargetNitroreductase NfsA
LigandBDBM50057440
Substrate/Competitorn/a
Meas. Tech.ChEMBL_206006 (CHEMBL840569)
IC50 4000±n/a nM
Citation Friedlos, FDenny, WAPalmer, BDSpringer, CJ Mustard prodrugs for activation by Escherichia coli nitroreductase in gene-directed enzyme prodrug therapy. J Med Chem40:1270-5 (1997) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Nitroreductase NfsA
Name:Nitroreductase NfsA
Synonyms:Modulator of drug activity A
Type:PROTEIN
Mol. Mass.:26851.30
Organism:Escherichia coli O157:H7
Description:ChEMBL_206006
Residue:240
Sequence:
MTPTIELTCGHRSIRHFTDEPISEAQREAIINSARATSSSSFLQCSSIIRITDKALREEL
VTLTGGQKHVAQAAEFWVFCADFNRHLQICPDAQLGLAEQLLLGVVDTAMMAQNALTAAE
SLGLGGVYIGGLRNNIEAVTKLLKLPQHVLPLFGLCLGWPADNPDLKPRLPSSILVHENS
YQPLDKDALAQYDEQLAEYYLTRGSNNRRDTWSDHIRRTIIKESRPFILDYLHKQGWATR
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50057440
n/a
NameBDBM50057440
Synonyms:2-[Bis-(2-iodo-ethyl)-amino]-N-(2,3-dihydroxy-propyl)-3,5-dinitro-benzamide | CHEMBL23938
TypeSmall organic molecule
Emp. Form.C14H18I2N4O7
Mol. Mass.608.1243
SMILESOCC(O)CNC(=O)c1cc(cc(c1N(CCI)CCI)[N+]([O-])=O)[N+]([O-])=O
Structure
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