Reaction Details |
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Target | Dihydrofolate reductase |
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Ligand | BDBM50171512 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_305776 (CHEMBL827965) |
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pH | 7.4±n/a |
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IC50 | 21000±n/a nM |
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Comments | extracted |
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Citation | Gangjee, A; Zeng, Y; McGuire, JJ; Kisliuk, RL Synthesis of classical, four-carbon bridged 5-substituted furo[2,3-d]pyrimidine and 6-substituted pyrrolo[2,3-d]pyrimidine analogues as antifolates. J Med Chem48:5329-36 (2005) [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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BDBM50171512 |
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n/a |
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Name | BDBM50171512 |
Synonyms: | (S)-2-{4-[4-(2,4-Diamino-furo[2,3-d]pyrimidin-5-yl)-butyl]-benzoylamino}-pentanedioic acid | CHEMBL193275 |
Type | Small organic molecule |
Emp. Form. | C22H25N5O6 |
Mol. Mass. | 455.4638 |
SMILES | Nc1nc(N)c2c(CCCCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)coc2n1 |
Structure |
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