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Structure paper

TitleStructures of falcipain-2 and falcipain-3 bound to small molecule inhibitors: implications for substrate specificity.
Journal, issue, pagesJ. Med. Chem., Vol. 52, Page 852-857, Year 2009
Publish dateDec 18, 2007 (structure data deposition date)
AuthorsKerr, I.D. / Lee, J.H. / Pandey, K.C. / Harrison, A. / Sajid, M. / Rosenthal, P.J. / Brinen, L.S.
External linksJ. Med. Chem. / PubMed:19128015
MethodsX-ray diffraction
Resolution2.5 - 2.9 Å
Structure data

PDB-3bpf:
Crystal Structure of Falcipain-2 with Its inhibitor, E64
Method: X-RAY DIFFRACTION / Resolution: 2.9 Å

PDB-3bpm:
Crystal Structure of Falcipain-3 with Its inhibitor, Leupeptin
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

Chemicals

ChemComp-E64:
N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-BUTYL]-GUANIDINE

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

ChemComp-SO4:
SULFATE ION

Source
  • plasmodium falciparum (malaria parasite P. falciparum)
  • streptomyces roseus (bacteria)
KeywordsHYDROLASE / falcipain / malaria / cysteine protease / Thiol protease / HYDROLASE/HYDROLASE INHIBITOR / HYDROLASE-HYDROLASE INHIBITOR complex

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