Ligand name: 3-[(2E)-2-[(2Z)-4-(1,3-dibutyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)but-2-en-1-ylidene]-1,3-benzoxazol-3(2H)-yl]propane-1-sulfonic acid
PDB ligand accession: 0UF
DrugBank: n/a
PubChem: 4073
ChEMBL: n/a
InChI Key: SKDUSRXOWAXOCO-UHFFFAOYSA-N
SMILES: CCCCN1C(=O)C(=CC=CC=C2N(c3ccccc3O2)CCCS(=O)(=O)O)C(=O)N(C1=S)CCCC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzoxazolines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P00698

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4FJR	Download	Experimental	e4fjrA1	Lysozyme-like	LigPlot