Reaction Details |
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Target | Dihydrofolate reductase |
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Ligand | BDBM50298803 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_674962 (CHEMBL1272639) |
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IC50 | 10000±n/a nM |
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Citation | Beierlein, JM; Karri, NG; Anderson, AC Targeted mutations of Bacillus anthracis dihydrofolate reductase condense complex structure-activity relationships. J Med Chem53:7327-36 (2010) [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 (DHFR) | baDHFR |
Type: | Enzyme |
Mol. Mass.: | 19120.62 |
Organism: | Bacillus anthracis |
Description: | baDHFR was expressed in E. coli BL21, and purified to homogeneity. |
Residue: | 162 |
Sequence: | MIVSFMVAMDENRVIGKDNNLPWRLPSELQYVKKTTMGHPLIMGRKNYEAIGRPLPGRRN
IIVTRNEGYHVEGCEVAHSVEEVFELCKNEEEIFIFGGAQIYDLFLPYVDKLYITKIHHA
FEGDTFFPEMDMTNWKEVFVEKGLTDEKNPYTYYYHVYEKQQ
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BDBM50298803 |
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n/a |
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Name | BDBM50298803 |
Synonyms: | (+/-)-6-methyl-5-(3-(3,4,5-trimethoxyphenyl)pent-1-ynyl)pyrimidine-2,4-diamine | CHEMBL574335 | Propargyl-substituted antifolate, 18 |
Type | Small organic molecule |
Emp. Form. | C19H24N4O3 |
Mol. Mass. | 356.4189 |
SMILES | CCC(C#Cc1c(C)nc(N)nc1N)c1cc(OC)c(OC)c(OC)c1 |
Structure |
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