3DG8

Quadruple mutant (N51I+C59R+S108N+I164L) Plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed with RJF670, NADPH, and dUMP

Summary for 3DG8

Entry DOI	10.2210/pdb3dg8/pdb
Related	1J3I 1J3J 1J3K 3DGA
Descriptor	Bifunctional dihydrofolate reductase-thymidylate synthase, N-(3,5-dimethoxyphenyl)imidodicarbonimidic diamide, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... (6 entities in total)
Functional Keywords	alpha-beta, methyltransferase, oxidoreductase, transferase
Biological source	Plasmodium falciparum More
Total number of polymer chains	4
Total formula weight	146434.24
Authors	Dasgupta, T.,Chitnumsub, P.,Maneeruttanarungroj, C.,Kamchonwongpaisan, S.,Nichols, S.,Lyons, T.M.,Tirado-Rives, J.,Jorgensen, W.L.,Yuthavong, Y.,Anderson, K.S. (deposition date: 2008-06-13, release date: 2009-01-27, Last modification date: 2023-08-30)
Primary citation	Dasgupta, T.,Chitnumsub, P.,Kamchonwongpaisan, S.,Maneeruttanarungroj, C.,Nichols, S.E.,Lyons, T.M.,Tirado-Rives, J.,Jorgensen, W.L.,Yuthavong, Y.,Anderson, K.S. Exploiting structural analysis, in silico screening, and serendipity to identify novel inhibitors of drug-resistant falciparum malaria. Acs Chem.Biol., 4:29-40, 2009 Cited by PubMed: 19146480 DOI: 10.1021/cb8002804 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.58 Å)

Structure validation