Ligand name: 2,6-dioxo-5-[2-(phenanthren-9-yl)ethyl]-1,2,3,6- tetrahydropyrimidine-4-carboxylic acid
PDB ligand accession: W73
DrugBank: n/a
PubChem: 73010359
ChEMBL: CHEMBL3991296
InChI Key: ALPWFSMWGPSLIH-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)cc(c3c2cccc3)CCC4=C(NC(=O)NC4=O)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Phenanthrenes and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q4D3W2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3W73	Download	Experimental	e3w73A1 e3w73B1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot