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Structure paper

TitleTuning mechanism-based inactivators of neuraminidases: mechanistic and structural insights.
Journal, issue, pagesAngew. Chem. Int. Ed. Engl., Vol. 53, Page 3382-3386, Year 2014
Publish dateOct 24, 2013 (structure data deposition date)
AuthorsBuchini, S. / Gallat, F.X. / Greig, I.R. / Kim, J.H. / Wakatsuki, S. / Chavas, L.M. / Withers, S.G.
External linksAngew. Chem. Int. Ed. Engl. / PubMed:24591206
MethodsX-ray diffraction
Resolution2.201 - 2.513 Å
Structure data

PDB-4nc5:
Human sialidase 2 in complex with 2,3-difluorosialic acid (covalent intermediate)
Method: X-RAY DIFFRACTION / Resolution: 2.513 Å

PDB-4ncs:
Human sialidase 2 in complex with 2,3-difluorosialic acid (covalent intermediate)
Method: X-RAY DIFFRACTION / Resolution: 2.201 Å

Chemicals

ChemComp-FSI:
5-acetamido-3,5-dideoxy-3-fluoro-D-erythro-alpha-L-manno-non-2-ulopyranosonic acid

ChemComp-PO4:
PHOSPHATE ION

ChemComp-HOH:
WATER

ChemComp-FSR:
(2S,3S,4R,5R,6R)-5-acetamido-2,3-bis(fluoranyl)-4-oxidanyl-6-[(1S,2S)-1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic

Source
  • homo sapiens (human)
KeywordsHYDROLASE / Human neuraminidase / sialidase / fluoro-sialic acid

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