Ligand name: (2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid
PDB ligand accession: A8S
DrugBank: DB16829
PubChem: 5280896
ChEMBL: CHEMBL288040
InChI Key: JLIDBLDQVAYHNE-YKALOCIXSA-N
SMILES: CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Prenol lipids
      • Subclass: Sesquiterpenoids

List of PDB structures and/or AlphaFold models with target protein K4N2F7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5ZCL	Download	Experimental	e5zclA1 e5zclC1 e5zclB1 e5zclD1	Ntn/PP2C TBP-like Ntn/PP2C TBP-like	LigPlot
5ZCG	Download	Experimental	e5zcgA1 e5zcgC1 e5zcgB1 e5zcgD1	Ntn/PP2C TBP-like Ntn/PP2C TBP-like	LigPlot
5GWP	Download	Experimental	e5gwpA1 e5gwpC1 e5gwpB1 e5gwpD1	Ntn/PP2C TBP-like Ntn/PP2C TBP-like	LigPlot
5GWO	Download	Experimental	e5gwoA1 e5gwoC1 e5gwoD1	Ntn/PP2C TBP-like TBP-like	LigPlot