| Reaction Details |
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 | Report a problem with these data |
| Target | Dihydrofolate reductase |
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| Ligand | BDBM50298811 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_588095 (CHEMBL1044821) |
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| IC50 | 17±n/a nM |
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| Citation |  Paulsen, JL; Liu, J; Bolstad, DB; Smith, AE; Priestley, ND; Wright, DL; Anderson, AC In vitro biological activity and structural analysis of 2,4-diamino-5-(2'-arylpropargyl)pyrimidine inhibitors of Candida albicans. Bioorg Med Chem17:4866-72 (2009) [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 |
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| Synonyms: | DFR1 | DYR_CANAX | Dihydrofolate Reductase (DHFR) | Tetrahydrofolate dehydrogenase |
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| Type: | Enzyme |
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| Mol. Mass.: | 22141.77 |
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| Organism: | Candida albicans |
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| Description: | C. albicans DHFR was expressed in E. coli BL21, and purified to homogeneity. |
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| Residue: | 192 |
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| Sequence: | MSKPNVAIIVAALKPALGIGYKGKMPWRLRKEIRYFKDVTTRTTKPNTRNAVIMGRKTWE
SIPQKFRPLPDRLNIILSRSYENKIIDDNIIHASSIESSLNLVSDVERVFIIGGAEIYNE
LINNSLVSHLLITEIEHPSPESIEMDTFLKFPLESWTKQPKSELQKFVGDTVLEDDIKEG
DFTYNYTLWTRK
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| BDBM50298811 |
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| n/a |
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| Name | BDBM50298811 |
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| Synonyms: | (S)-5-(3-(5-methoxy-3',5'-dimethylbiphenyl-3-yl)but-1-ynyl)-6-methylpyrimidine-2,4-diamine | CHEMBL575009 |
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| Type | Small organic molecule |
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| Emp. Form. | C24H26N4O |
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| Mol. Mass. | 386.4894 |
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| SMILES | COc1cc(cc(c1)-c1cc(C)cc(C)c1)[C@H](C)C#Cc1c(C)nc(N)nc1N |r| |
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| Structure | 
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