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Reaction Details
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TargetDihydrofolate reductase
LigandBDBM50029760
Substrate/Competitorn/a
Meas. Tech.ChEMBL_54726 (CHEMBL668339)
Ki 4.5±n/a nM
Citation Selassie, CDLi, RLPoe, MHansch, C On the optimization of hydrophobic and hydrophilic substituent interactions of 2,4-diamino-5-(substituted-benzyl)pyrimidines with dihydrofolate reductase. J Med Chem34:46-54 (1991) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Dihydrofolate reductase
Name:Dihydrofolate reductase
Synonyms:1.5.1.3 | Dihydrofolate reductase | folA | t0090
Type:PROTEIN
Mol. Mass.:17976.56
Organism:Salmonella enterica subsp. enterica serovar Typhi
Description:ChEMBL_13019
Residue:159
Sequence:
MISLIAALAVDRVIGMENAMPWNLPADLAWFKRNTLNKPVVMGRHTWESIGRPLPGRKNI
IISSQPGTDDRVQWVKSVDEAIAACGDAPEIMVIGGGRVYEQFLPKAQKLYLTHIDAEVE
GDTHFPDYEPDDWESVFSEFHDADAQNSHSYCFEILERR
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  Blast E-value cutoff:
BDBM50029760
n/a
NameBDBM50029760
Synonyms:5-[3,5-Dimethoxy-4-(2-methoxy-ethoxy)-benzyl]-pyrimidine-2,4-diamine | 5-[3,5-Dimethoxy-4-(2-methoxy-ethoxy)-benzyl]-pyrimidine-2,4-diamine(Tetroxoprim ) | CHEMBL32039 | Tetroxoprim
TypeSmall organic molecule
Emp. Form.C16H22N4O4
Mol. Mass.334.3703
SMILESCOCCOc1c(OC)cc(Cc2cnc(N)nc2N)cc1OC
Structure
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