4H96
Candida albicans dihydrofolate reductase complexed with NADPH and 5-{3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methoxyphenyl]prop-1-yn-1-yl}-6-ethylpyrimidine-2,4-diamine (UCP1018)
Summary for 4H96
Entry DOI | 10.2210/pdb4h96/pdb |
Related | 3QLR 3QLS 3QLW 3QLX 3QLY 3QLZ 4H95 4H97 4H98 |
Descriptor | Dihydrofolate Reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 5-{3-[3-(1,3-benzodioxol-5-yl)-5-methoxyphenyl]prop-1-yn-1-yl}-6-ethylpyrimidine-2,4-diamine, ... (4 entities in total) |
Functional Keywords | antifungal agents, candida albicans, drug design, enzyme inhibitors, fungal proteins, tetrahydrofolate dehydrogenase, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor |
Biological source | Candida albicans |
Total number of polymer chains | 2 |
Total formula weight | 45937.72 |
Authors | Paulsen, J.L.,Anderson, A.C. (deposition date: 2012-09-24, release date: 2013-03-27, Last modification date: 2023-09-20) |
Primary citation | Paulsen, J.L.,Viswanathan, K.,Wright, D.L.,Anderson, A.C. Structural analysis of the active sites of dihydrofolate reductase from two species of Candida uncovers ligand-induced conformational changes shared among species. Bioorg.Med.Chem.Lett., 23:1279-1284, 2013 Cited by PubMed: 23375226DOI: 10.1016/j.bmcl.2013.01.008 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.6 Å) |
Structure validation
Download full validation report