Ligand name: N-acetyl-alpha-neuraminic acid
PDB ligand accession: SIA
DrugBank: DB03721
PubChem: 444885
ChEMBL: CHEMBL1234621
InChI Key: SQVRNKJHWKZAKO-YRMXFSIDSA-N
SMILES: CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)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 Q9UK77

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2HRQ	Download	Experimental	e2hrqB1 e2hrqA1 e2hrqB1 e2hrqC1 e2hrqC1 e2hrqA1 e2hrqE1 e2hrqD1 e2hrqF1 e2hrqE1 e2hrqF1 e2hrqD1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
2HRR	Download	Experimental	e2hrrA1 e2hrrB1 e2hrrB1 e2hrrC1 e2hrrA1 e2hrrC1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot