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 Q700S9

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1XC6	Download	Experimental	e1xc6A1 e1xc6A5 e1xc6A5 e1xc6A4 e1xc6A5 e1xc6A1 e1xc6A1 e1xc6A2 e1xc6A5	jelly-roll TIM beta/alpha-barrel TIM beta/alpha-barrel Beta-galactosidase LacA, domain 3 TIM beta/alpha-barrel jelly-roll jelly-roll jelly-roll TIM beta/alpha-barrel	LigPlot
1TG7	Download	Experimental	e1tg7A1 e1tg7A5 e1tg7A5 e1tg7A4 e1tg7A5 e1tg7A1 e1tg7A1 e1tg7A2 e1tg7A5	jelly-roll TIM beta/alpha-barrel TIM beta/alpha-barrel Beta-galactosidase LacA, domain 3 TIM beta/alpha-barrel jelly-roll jelly-roll jelly-roll TIM beta/alpha-barrel	LigPlot