Reaction Details |
| Report a problem with these data |
Target | Dihydrofolate reductase |
---|
Ligand | BDBM26521 |
---|
Substrate/Competitor | BDBM18044 |
---|
Meas. Tech. | Enzyme Inhibition Assay |
---|
IC50 | 57±n/a nM |
---|
Citation | Beierlein, JM; Frey, KM; Bolstad, DB; Pelphrey, PM; Joska, TM; Smith, AE; Priestley, ND; Wright, DL; Anderson, AC Synthetic and Crystallographic Studies of a New Inhibitor Series Targeting Bacillus anthracis Dihydrofolate Reductase. J Med Chem51:7532-40 (2008) [PubMed] Article |
---|
More Info.: | Get all data from this article, Solution Info, Assay Method |
---|
|
Dihydrofolate reductase |
---|
Name: | Dihydrofolate reductase |
Synonyms: | DHFR | DYR_HUMAN | Dihydrofolate reductase (DHFR) | Tetrahydrofolate dehydrogenase |
Type: | Enzyme |
Mol. Mass.: | 21453.99 |
Organism: | Homo sapiens (Human) |
Description: | Recombinant human DHFR. |
Residue: | 187 |
Sequence: | MVGSLNCIVAVSQNMGIGKNGDLPWPPLRNEFRYFQRMTTTSSVEGKQNLVIMGKKTWFS
IPEKNRPLKGRINLVLSRELKEPPQGAHFLSRSLDDALKLTEQPELANKVDMVWIVGGSS
VYKEAMNHPGHLKLFVTRIMQDFESDTFFPEIDLEKYKLLPEYPGVLSDVQEEKGIKYKF
EVYEKND
|
|
|
BDBM26521 |
---|
BDBM18044 |
---|
Name | BDBM26521 |
Synonyms: | 6-ethyl-5-[3-(3,4,5-trimethoxyphenyl)prop-1-yn-1-yl]pyrimidine-2,4-diamine | Propargyl inhibitor, 20 |
Type | Small organic molecule |
Emp. Form. | C18H22N4O3 |
Mol. Mass. | 342.3923 |
SMILES | CCc1nc(N)nc(N)c1C#CCc1cc(OC)c(OC)c(OC)c1 |
Structure |
|