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Structure paper

TitleIn vitro and in vivo studies of the trypanocidal properties of WRR-483 against Trypanosoma cruzi.
Journal, issue, pagesPlos Negl Trop Dis, Vol. 4, Year 2010
Publish dateFeb 25, 2010 (structure data deposition date)
AuthorsChen, Y.T. / Brinen, L.S. / Kerr, I.D. / Hansell, E. / Doyle, P.S. / McKerrow, J.H. / Roush, W.R.
External linksPlos Negl Trop Dis / PubMed:20856868
MethodsX-ray diffraction
Resolution1.5 Å
Structure data

PDB-3lxs:
Crystal structure analysis of cruzain bound to vinyl sulfone derived inhibitor (WRR483)
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

Chemicals

ChemComp-4MC:
(Z)-N-(5-GUANIDINO-1-OXO-1-(5-PHENYL-1-(PHENYLSULFONYL)PENT-1-EN-3-YLAMINO)PENTAN-2-YL)-4-METHYLPIPERAZINE-1-CARBOXAMID

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

Source
  • trypanosoma cruzi (eukaryote)
KeywordsHYDROLASE / CYSTEINE PROTEASE / COVALENT INHIBITOR / VINYL SULFONAMIDE

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