Ligand name: 2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID
PDB ligand accession: DAN
DrugBank: DB03991
PubChem: 65309
ChEMBL: CHEMBL96712
InChI Key: JINJZWSZQKHCIP-UFGQHTETSA-N
SMILES: CC(=O)NC1C(C=C(OC1C(C(CO)O)O)C(=O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Alcohols and polyols

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein Q9Y3R4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2F29	Download	Experimental	e2f29A1 e2f29B1	beta-propeller-like beta-propeller-like	LigPlot
2F27	Download	Experimental	e2f27A1 e2f27B1	beta-propeller-like beta-propeller-like	LigPlot
2F25	Download	Experimental	e2f25A1 e2f25B1	beta-propeller-like beta-propeller-like	LigPlot
1VCU	Download	Experimental	e1vcuA1 e1vcuB1	beta-propeller-like beta-propeller-like	LigPlot