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TitleDihydropyrancarboxamides related to zanamivir: a new series of inhibitors of influenza virus sialidases. 2. Crystallographic and molecular modeling study of complexes of 4-amino-4H-pyran-6-carboxamides and sialidase from influenza virus types A and B.
Journal, issue, pagesJ. Med. Chem., Vol. 41, Page 798-807, Year 1998
Publish dateJan 29, 1998 (structure data deposition date)
AuthorsTaylor, N.R. / Cleasby, A. / Singh, O. / Skarzynski, T. / Wonacott, A.J. / Smith, P.W. / Sollis, S.L. / Howes, P.D. / Cherry, P.C. / Bethell, R. ...Taylor, N.R. / Cleasby, A. / Singh, O. / Skarzynski, T. / Wonacott, A.J. / Smith, P.W. / Sollis, S.L. / Howes, P.D. / Cherry, P.C. / Bethell, R. / Colman, P. / Varghese, J.
External linksJ. Med. Chem. / PubMed:9526556
MethodsX-ray diffraction
Resolution1.9 - 2.2 Å
Structure data

PDB-1a4g:
INFLUENZA VIRUS B/BEIJING/1/87 NEURAMINIDASE COMPLEXED WITH ZANAMIVIR
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-1a4q:
INFLUENZA VIRUS B/BEIJING/1/87 NEURAMINIDASE COMPLEXED WITH DIHYDROPYRAN-PHENETHYL-PROPYL-CARBOXAMIDE
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-1bji:
THE X-RAY STRUCTURE OF A COMPLEX OF TERN N9 INFLUENZA VIRUS NEURAMINIDASE COMPLEXED WITH THE GLAXO 6-CARBOXAMIDE SIALIC ACID ANALOGUE GR217029
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

ChemComp-CA:
Unknown entry

ChemComp-ZMR:
ZANAMIVIR / medication, antivirus, inhibitor*YM

ChemComp-HOH:
WATER

ChemComp-DPC:
5-ACETYLAMINO-4-AMINO-6-(PHENETHYL-PROPYL-CARBAMOYL)-5,6-DIHYDRO-4H-PYRAN-2-CARBOXYLIC ACID

ChemComp-MAN:
alpha-D-mannopyranose

Source
  • influenza b virus (strain b/beijing/1/87)
  • influenza a virus
KeywordsHYDROLASE / GLYCOSIDASE / GLYCOSYLATED PROTEIN / NEURAMINIDASE / INFLUENZA PROTEIN / INHIBITOR COMPLEX / 6-CARBOXAMIDE DERIVATIVE / SIALIC ACID ANALOGUE / GLAXO GR217029 / GLYCOPROTEIN

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