Ligand name: (3S,7R,11E)-7,14,16-trihydroxy-3-methyl-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-1-one
PDB ligand accession: 36J
DrugBank: n/a
PubChem: 5284645
ChEMBL: CHEMBL371463
InChI Key: FPQFYIAXQDXNOR-QDKLYSGJSA-N
SMILES: CC1CCCC(CCCC=Cc2cc(cc(c2C(=O)O1)O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Macrolides and analogues
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein A0A0D2ILK1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5XO7	Download	Experimental	e5xo7A1 e5xo7B1 e5xo7C1 e5xo7D1 e5xo7E1 e5xo7F1 e5xo7G1 e5xo7H1	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
5Z7J	Download	Experimental	e5z7jA1 e5z7jB1 e5z7jC1 e5z7jD1 e5z7jE1 e5z7jF1 e5z7jG1 e5z7jH1	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