3KJS

Crystal Structure of T. cruzi DHFR-TS with 3 high affinity DHFR inhibitors: DQ1 inhibitor complex

Summary for 3KJS

Entry DOI	10.2210/pdb3kjs/pdb
Related	2H2Q 3CL9 3CLB 3KJU 3KJW
Descriptor	Dihydrofolate reductase-thymidylate synthase, ethyl 4-(5-{[(2,4-diaminoquinazolin-6-yl)methyl]amino}-2-methoxyphenoxy)butanoate, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... (6 entities in total)
Functional Keywords	oxidoreductase, transferase
Biological source	Trypanosoma cruzi
Total number of polymer chains	4
Total formula weight	241867.23
Authors	Schormann, N.,Senkovich, O.,Chattopadhyay, D. (deposition date: 2009-11-03, release date: 2010-06-09, Last modification date: 2023-09-06)
Primary citation	Schormann, N.,Velu, S.E.,Murugesan, S.,Senkovich, O.,Walker, K.,Chenna, B.C.,Shinkre, B.,Desai, A.,Chattopadhyay, D. Synthesis and characterization of potent inhibitors of Trypanosoma cruzi dihydrofolate reductase. Bioorg.Med.Chem., 18:4056-4066, 2010 Cited by PubMed: 20452776 DOI: 10.1016/j.bmc.2010.04.020 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.5 Å)

Structure validation