Ligand name: (2S)-2-[4'-({dimethyl[2-(phosphonooxy)ethyl]ammonio}acetyl)biphenyl-4-yl]-2-hydroxy-4,4-dimethylmorpholin-4-ium
PDB ligand accession: HC7
DrugBank: n/a
PubChem: 25113187
ChEMBL: n/a
InChI Key: MERLSFHNUMSODQ-XMMPIXPASA-P
SMILES: C[N+]1(CCOC(C1)(c2ccc(cc2)c3ccc(cc3)C(=O)C[N+](C)(C)CCOP(=O)(O)O)O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

List of PDB structures and/or AlphaFold models with target protein Q9Y259

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3FEG	Download	Experimental	e3fegA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
3LQ3	Download	Experimental	e3lq3A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot