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TargetBifunctional dihydrofolate reductase-thymidylate synthase [1-238,S58R,S117N]
LigandBDBM18776
Substrate/CompetitorBDBM18044
Meas. Tech.Inhibitor Screening Using Bacterial System (IC50) and Measurement of Inhibition Constant (Ki)
Ki 28.07±n/a nM
IC50 18220±n/a nM
Citation Bunyarataphan, SLeartsakulpanich, UTaweechai, STarnchompoo, BKamchonwongpaisan, SYuthavong, Y Evaluation of the activities of pyrimethamine analogs against Plasmodium vivax and Plasmodium falciparum dihydrofolate reductase-thymidylate synthase using in vitro enzyme inhibition and bacterial complementation assays. Antimicrob Agents Chemother50:3631-7 (2006) [PubMed]  Article
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Bifunctional dihydrofolate reductase-thymidylate synthase [1-238,S58R,S117N]
Name:Bifunctional dihydrofolate reductase-thymidylate synthase [1-238,S58R,S117N]
Synonyms:DRTS_PLAVI | Dihydrofolate Reductase-Thymidylate Synthase (DHFR-TS) Muatnt (S58R/S117N) | Dihydrofolate Reductase-Thymidylate Synthase (DHFR-TS) Mutant SP21
Type:Enzyme
Mol. Mass.:27235.37
Organism:Plasmodium vivax (malaria parasite P. vivax)
Description:O02604[1-238,S58R,S117N]
Residue:238
Sequence:
MENLSDVFDIYAICACCKVAPTSEGTKNEPFSPRTFRGLGNKGTLPWKCNSVDMKYFRSV
TTYVDESKYEKLKWKRERYLRMEASQGGGDNTSGGDNTHGGDNADKLQNVVVMGRSNWES
IPKQYKPLPNRINVVLSKTLTKEDVKEKVFIIDSIDDLLLLLKKLKYYKCFIIGGAQVYR
ECLSRNLIKQIYFTRINGAYPCDVFFPEFDESEFRVTSVSEVYNSKGTTLDFLVYSKV
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BDBM18776
BDBM18044
NameBDBM18776
Synonyms:5-(4-chlorophenyl)-6-(2-methylpropyl)pyrimidine-2,4-diamine
TypeSmall organic molecule
Emp. Form.C14H17ClN4
Mol. Mass.276.765
SMILESCC(C)Cc1nc(N)nc(N)c1-c1ccc(Cl)cc1
Structure
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