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TargetBifunctional dihydrofolate reductase-thymidylate synthase
LigandBDBM50291779
Substrate/Competitorn/a
Meas. Tech.ChEMBL_55096 (CHEMBL875027)
Ki 6.026E3±n/a nM
Citation Booth, RGSelassie, CDHansch, CSanti, DV Quantitative structure-activity relationship of triazine-antifolate inhibition of Leishmania dihydrofolate reductase and cell growth. J Med Chem30:1218-24 (1987) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Bifunctional dihydrofolate reductase-thymidylate synthase
Name:Bifunctional dihydrofolate reductase-thymidylate synthase
Synonyms:DHFR-TS | DRTS_LEIMA | Thymidylate synthase (TS)
Type:Protein
Mol. Mass.:58691.04
Organism:Leishmania major
Description:P07382
Residue:520
Sequence:
MSRAAARFKIPMPETKADFAFPSLRAFSIVVALDMQHGIGDGESIPWRVPEDMTFFKNQT
TLLRNKKPPTEKKRNAVVMGRKTWESVPVKFRPLKGRLNIVLSSKATVEELLAPLPEGQR
AAAAQDVVVVNGGLAEALRLLARPLYCSSIETAYCVGGAQVYADAMLSPCIEKLQEVYLT
RIYATAPACTRFFPFPPENAATAWDLASSQGRRKSEAEGLEFEICKYVPRNHEERQYLEL
IDRIMKTGIVKEDRTGVGTISLFGAQMRFSLRDNRLPLLTTKRVFWRGVCEELLWFLRGE
TSAQLLADKDIHIWDGNGSREFLDSRGLTENKEMDLGPVYGFQWRHFGADYKGFEANYDG
EGVDQIKLIVETIKTNPNDRRLLVTAWNPCALQKMALPPCHLLAQFYVNTDTSELSCMLY
QRSCDMGLGVPFNIASYALLTILIAKATGLRPGELVHTLGDAHVYRNHVDALKAQLERVP
HAFPTLIFKEERQYLEDYELTDMEVIDYVPHPAIKMEMAV
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  Blast E-value cutoff:
BDBM50291779
n/a
NameBDBM50291779
Synonyms:3-(4,6-Diamino-2,2-dimethyl-2H-[1,3,5]triazin-1-yl)-benzonitrile | CHEMBL268914
TypeSmall organic molecule
Emp. Form.C12H14N6
Mol. Mass.242.2798
SMILESCC1(C)N=C(N)N=C(N)N1c1cccc(c1)C#N |t:3,6|
Structure
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