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 A0A0J9X252

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5TGU	Download	Experimental	e5tguA1 e5tguE1 e5tguA1 e5tguC1 e5tguC1 e5tguE1	jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll	LigPlot
5TH1	Download	Experimental	e5th1A1 e5th1E1 e5th1C1 e5th1B1 e5th1C1 e5th1E1	jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain jelly-roll jelly-roll	LigPlot
5TH0	Download	Experimental	e5th0A1 e5th0E1 e5th0A1 e5th0C1 e5th0B1 e5th0E1 e5th0D1	jelly-roll jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain jelly-roll Hemagglutinin HA2 chain	LigPlot
5TGV	Download	Experimental	e5tgvA1 e5tgvB1 e5tgvA1 e5tgvC1 e5tgvC1 e5tgvE1 e5tgvE1 e5tgvA1	jelly-roll Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll	LigPlot
5THC	Download	Experimental	e5thcA1 e5thcE1 e5thcC1 e5thcE1 e5thcD1 e5thcA1 e5thcE1	jelly-roll jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain jelly-roll jelly-roll	LigPlot
4WSX	Download	Experimental	e4wsxA1 e4wsxO1 e4wsxW1 e4wsxB1 e4wsxX1 e4wsxC1 e4wsxU1 e4wsxM1 e4wsxD1 e4wsxN1 e4wsxE1 e4wsxS1 e4wsxK1 e4wsxF1 e4wsxL1 e4wsxG1 e4wsxQ1 e4wsxI1 e4wsxH1 e4wsxJ1 e4wsxG1 e4wsxI1 e4wsxQ1 e4wsxJ1 e4wsxR1 e4wsxE1 e4wsxK1 e4wsxS1 e4wsxL1 e4wsxT1 e4wsxC1 e4wsxM1 e4wsxU1 e4wsxN1 e4wsxV1 e4wsxO1 e4wsxW1 e4wsxA1 e4wsxB1 e4wsxP1 e4wsxI1 e4wsxQ1 e4wsxG1 e4wsxH1 e4wsxR1 e4wsxK1 e4wsxS1 e4wsxE1 e4wsxF1 e4wsxT1 e4wsxM1 e4wsxU1 e4wsxC1 e4wsxU1 e4wsxD1 e4wsxV1 e4wsxA1 e4wsxW1 e4wsxO1 e4wsxP1 e4wsxX1	jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain	LigPlot
5THB	Download	Experimental	e5thbA1 e5thbE1 e5thbC1 e5thbB1 e5thbE1 e5thbD1 e5thbA1 e5thbB1 e5thbF1	jelly-roll jelly-roll jelly-roll Hemagglutinin HA2 chain jelly-roll Hemagglutinin HA2 chain jelly-roll Hemagglutinin HA2 chain Hemagglutinin HA2 chain	LigPlot
5TGO	Download	Experimental	e5tgoA1 e5tgoE1 e5tgoA1 e5tgoC1	jelly-roll jelly-roll jelly-roll jelly-roll	LigPlot
6WF1	Download	Experimental	e6wf1A1	jelly-roll	LigPlot