Reaction Details |
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Target | Dihydrofolate reductase |
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Ligand | BDBM50027976 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEBML_54924 |
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Ki | 4.1±n/a nM |
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Citation | Birdsall, B; Feeney, J; Pascual, C; Roberts, GC; Kompis, I; Then, RL; Müller, K; Kroehn, A A 1H NMR study of the interactions and conformations of rationally designed brodimoprim analogues in complexes with Lactobacillus casei dihydrofolate reductase. J Med Chem27:1672-6 (1985) [PubMed] |
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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: | DYR_LACCA | dhfR | folA |
Type: | PROTEIN |
Mol. Mass.: | 18437.08 |
Organism: | Lactobacillus casei |
Description: | ChEMBL_1357878 |
Residue: | 163 |
Sequence: | MTAFLWAQDRDGLIGKDGHLPWHLPDDLHYFRAQTVGKIMVVGRRTYESFPKRPLPERTN
VVLTHQEDYQAQGAVVVHDVAAVFAYAKQHPDQELVIAGGAQIFTAFKDDVDTLLVTRLA
GSFEGDTKMIPLNWDDFTKVSSRTVEDTNPALTHTYEVWQKKA
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BDBM50027976 |
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n/a |
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Name | BDBM50027976 |
Synonyms: | CHEMBL45202 | {3-[2-Bromo-5-(2,4-diamino-pyrimidin-5-ylmethyl)-3-methoxy-phenoxy]-propionylamino}-acetic acid |
Type | Small organic molecule |
Emp. Form. | C17H20BrN5O5 |
Mol. Mass. | 454.275 |
SMILES | COc1cc(Cc2cnc(N)nc2N)cc(OCCC(=O)NCC(O)=O)c1Br |
Structure |
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