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Structure paper

TitleBestatin-based chemical biology strategy reveals distinct roles for malaria M1- and M17-family aminopeptidases
Journal, issue, pagesProc. Natl. Acad. Sci. USA, Vol. 108, Page E526-E534, Year 2011
Publish dateAug 1, 2011 (structure data deposition date)
AuthorsHarbut, M.B. / Velmourougane, G. / Dalal, S. / Reiss, G. / Whisstock, J.C. / Onder, O. / Brisson, D. / McGowan, S. / Klemba, M. / Greenbaum, D.C.
External linksProc. Natl. Acad. Sci. USA / PubMed:21844374
MethodsX-ray diffraction
Resolution1.8 - 2 Å
Structure data

PDB-3t8v:
A bestatin-based chemical biology strategy reveals distinct roles for malaria M1- and M17-family aminopeptidases
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

PDB-3t8w:
A bestatin-based chemical biology strategy reveals distinct roles for malaria M1- and M17-family aminopeptidases
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-MG:
Unknown entry

ChemComp-BTJ:
N-[(2-{2-[(N-{(2S,3R)-3-amino-4-[4-(benzyloxy)phenyl]-2-hydroxybutanoyl}-L-alanyl)amino]ethoxy}ethoxy)acetyl]-4-benzoyl-L-phenylalanyl-N~6~-hex-5-ynoyllysinamide

ChemComp-HOH:
WATER

ChemComp-CO3:
CARBONATE ION

ChemComp-DGZ:
N-((2R,3S,6S,18S,21S)-2-amino-18-(4-benzoylbenzyl)-21-carbamoyl-3-hydroxy-6-(naphthalen-2-ylmethyl)-4,7,16,19-tetraoxo-1-phenyl-11,14-dioxa-5,8,17,20-tetraazapentacosan-25-yl)hex-5-ynamide

ChemComp-SO4:
SULFATE ION

ChemComp-1PE:
PENTAETHYLENE GLYCOL / precipitant*YM

ChemComp-2PE:
NONAETHYLENE GLYCOL / precipitant*YM

Source
  • plasmodium falciparum (malaria parasite P. falciparum)
KeywordsHYDROLASE/HYDROLASE INHIBITOR / M1 alanyl-aminopeptidase / protease / metallo-aminopeptidase / HYDROLASE-HYDROLASE INHIBITOR complex / M17-leucyl aminopeptidase

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