Molecular simulations of carbohydrates with a fucose-binding burkholderia ambifaria lectin suggest modulation by surface residues outside the fucose-binding pocket

HIGHLIGHTS

• who: Elizabeth Yuriev and Paul A. Ramsland from the University of São Paulo, Brazil have published the paper: Molecular Simulations of Carbohydrates with a Fucose-Binding Burkholderia ambifaria Lectin Suggest Modulation by Surface Residues Outside the Fucose-Binding Pocket, in the Journal: (JOURNAL)
• what: The aim of this computational study was to characterize BambL-saccharide binding modes and to inform future in silico or structure-based design of inhibitors for this bacterial lectin. Generation of BambL-Blood Group Complexes by Docking To decide which of the crystallographic BambL receptor structures to use in this . . .
  

   

  

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