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TitleSynthesis and characterization of potent inhibitors of Trypanosoma cruzi dihydrofolate reductase.
Journal, issue, pagesBioorg. Med. Chem., Vol. 18, Page 4056-4066, Year 2010
Publish dateNov 3, 2009 (structure data deposition date)
AuthorsSchormann, N. / Velu, S.E. / Murugesan, S. / Senkovich, O. / Walker, K. / Chenna, B.C. / Shinkre, B. / Desai, A. / Chattopadhyay, D.
External linksBioorg. Med. Chem. / PubMed:20452776
MethodsX-ray diffraction
Resolution2.5 Å
Structure data

PDB-3kjs:
Crystal Structure of T. cruzi DHFR-TS with 3 high affinity DHFR inhibitors: DQ1 inhibitor complex
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

Chemicals

ChemComp-DQ1:
ethyl 4-(5-{[(2,4-diaminoquinazolin-6-yl)methyl]amino}-2-methoxyphenoxy)butanoate

ChemComp-NAP:
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE

ChemComp-SO4:
SULFATE ION

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HOH:
WATER

Source
  • trypanosoma cruzi (eukaryote)
KeywordsOxidoreductase / Transferase

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