Target
Dihydrofolate reductase
Ligand
BDBM50043799
Substrate
n/a
Meas. Tech.
ChEMBL_1988113 (CHEMBL4621660)
Ki
880000±n/a nM
Citation
 Duff, MRGabel, SAPedersen, LCDeRose, EFKrahn, JMHowell, EELondon, RE The Structural Basis for Nonsteroidal Anti-Inflammatory Drug Inhibition of Human Dihydrofolate Reductase. J Med Chem 63:8314-8324 (2020) [PubMed]  Article 
Target
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:
MVGSLNCIVAVSQNMGIGKNGDLPWPPLRNEFRYFQRMTTTSSVEGKQNLVIMGKKTWFSIPEKNRPLKGRINLVLSRELKEPPQGAHFLSRSLDDALKLTEQPELANKVDMVWIVGGSSVYKEAMNHPGHLKLFVTRIMQDFESDTFFPEIDLEKYKLLPEYPGVLSDVQEEKGIKYKFEVYEKND
  
Inhibitor
Name:
BDBM50043799
Synonyms:
(2R)-2-amino-3-(1H-indol-3-yl)propanoic acid | (R)-tryptophan | CHEMBL292303 | D-TRYPTOPHAN
Type:
Small organic molecule
Emp. Form.:
C11H12N2O2
Mol. Mass.:
204.2252
SMILES:
N[C@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
Structure:
Search PDB for entries with ligand similarity: