Reaction Details |
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Target | Dihydrofolate reductase |
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Ligand | BDBM50291779 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1525190 (CHEMBL3635311) |
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Kd | 8740±n/a nM |
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Citation | Srinivasan, B; Tonddast-Navaei, S; Skolnick, J Ligand binding studies, preliminary structure-activity relationship and detailed mechanistic characterization of 1-phenyl-6,6-dimethyl-1,3,5-triazine-2,4-diamine derivatives as inhibitors of Escherichia coli dihydrofolate reductase. Eur J Med Chem103:600-14 (2015) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Dihydrofolate reductase |
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Name: | Dihydrofolate reductase |
Synonyms: | Dihydrofolate reductase (F31V) | dfrA17 |
Type: | n/a |
Mol. Mass.: | 17532.46 |
Organism: | Escherichia coli |
Description: | n/a |
Residue: | 157 |
Sequence: | MKISLISAVSESGVIGSGPDIPWSVKGEQLLFKALTYNQWLLVGRKTFDSMGVLPNRKYA
VVSKNGISSSNENVLVFPSIENALKELSKVTDHVYVSGGGQIYNSLIEKADIIHLSTVHV
EVEGDIKFPIMPENFNLVFEQFFMSNINYTYQIWKKG
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BDBM50291779 |
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n/a |
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Name | BDBM50291779 |
Synonyms: | 3-(4,6-Diamino-2,2-dimethyl-2H-[1,3,5]triazin-1-yl)-benzonitrile | CHEMBL268914 |
Type | Small organic molecule |
Emp. Form. | C12H14N6 |
Mol. Mass. | 242.2798 |
SMILES | CC1(C)N=C(N)N=C(N)N1c1cccc(c1)C#N |t:3,6| |
Structure |
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