Ligand name: 2-acetamido-2-deoxy-beta-D-glucopyranose
PDB ligand accession: NAG
DrugBank: DB00141
PubChem: 24139
ChEMBL: CHEMBL447878
InChI Key: OVRNDRQMDRJTHS-FMDGEEDCSA-N
SMILES: CC(=O)NC1C(C(C(OC1O)CO)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbohydrates and carbohydrate conjugates

List of PDB structures and/or AlphaFold models with target protein B2BN53

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6WXF	Download	Experimental	e6wxfG2 e6wxfg1 e6wxf11 e6wxf31 e6wxfN1 e6wxfN2 e6wxfn1 e6wxf31	jelly-roll Flavodoxin-like Helical domain in outer capsid protein VP4 Helical domain in outer capsid protein VP4 jelly-roll A virus capsid protein alpha-helical domain Flavodoxin-like Helical domain in outer capsid protein VP4	LigPlot
6WXE	Download	Experimental	e6wxe11 e6wxeF2 e6wxed1 e6wxe11 e6wxeG2 e6wxeg1 e6wxe31 e6wxe22 e6wxeM2 e6wxeN1 e6wxeN2 e6wxen2 e6wxe31	Helical domain in outer capsid protein VP4 jelly-roll Flavodoxin-like Helical domain in outer capsid protein VP4 jelly-roll Flavodoxin-like Helical domain in outer capsid protein VP4 Helical domain in outer capsid protein VP4 jelly-roll A virus capsid protein alpha-helical domain jelly-roll Flavodoxin-like Helical domain in outer capsid protein VP4	LigPlot
6WXG	Download	Experimental	e6wxgI2 e6wxgg2 e6wxgN1 e6wxgN2 e6wxgo2	jelly-roll Flavodoxin-like jelly-roll A virus capsid protein alpha-helical domain Flavodoxin-like	LigPlot