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TitleEvaluation of adamantane hydroxamates as botulinum neurotoxin inhibitors: synthesis, crystallography, modeling, kinetic and cellular based studies.
Journal, issue, pagesBioorg. Med. Chem., Vol. 21, Page 1344-1348, Year 2013
Publish dateOct 4, 2012 (structure data deposition date)
AuthorsSilhar, P. / Silvaggi, N.R. / Pellett, S. / Johnson, E.A. / Allen, K.N. / Janda, K.D.
External linksBioorg. Med. Chem. / PubMed:23340139
MethodsX-ray diffraction
Resolution2.5 Å
Structure data

PDB-4hev:
Clostridium Botulinum Serotype A Light Chain Inhibited By Adamantane Hydroxamate
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-AXM:
N-hydroxy-2-[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-yl]acetamide

ChemComp-HOH:
WATER

Source
  • clostridium botulinum (bacteria)
KeywordsHYDROLASE/HYDROLASE INHIBITOR / Zn2+-dependent metalloprotease / HYDROLASE-HYDROLASE INHIBITOR complex

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