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TitleFlipping in the Pore: Discovery of Dual Inhibitors That Bind in Different Orientations to the Wild-Type versus the Amantadine-Resistant S31N Mutant of the Influenza A Virus M2 Proton Channel.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 136, Page 17987-17995, Year 2014
Publish dateSep 18, 2014 (structure data deposition date)
AuthorsWu, Y. / Canturk, B. / Jo, H. / Ma, C. / Gianti, E. / Klein, M.L. / Pinto, L.H. / Lamb, R.A. / Fiorin, G. / Wang, J. / DeGrado, W.F.
External linksJ. Am. Chem. Soc. / PubMed:25470189
MethodsNMR (solution)
Structure data

PDB-2muv:
NOE-based model of the influenza A virus M2 (19-49) bound to drug 11
Method: SOLUTION NMR

PDB-2muw:
NOE-based model of the influenza A virus N31S mutant (19-49) bound to drug 11
Method: SOLUTION NMR

Chemicals

ChemComp-3LW:
(3s,5s,7s)-N-[(5-bromothiophen-2-yl)methyl]tricyclo[3.3.1.1~3,7~]decan-1-aminium

Source
  • influenza a virus
KeywordsVIRAL PROTEIN / drug design / M2

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