Ligand name: 3-({4-[(2,4-dimethyl-5-sulfophenyl)amino]-9,10-dioxo-9,10-dihydroanthracen-1-yl}amino)-2,4,6-trimethylbenzenesulfonic acid
PDB ligand accession: QV6
DrugBank: n/a
PubChem: 53245704
ChEMBL: n/a
InChI Key: WWMZMGAHGSMSEO-UHFFFAOYSA-N
SMILES: Cc1cc(c(cc1Nc2ccc(c3c2C(=O)c4ccccc4C3=O)Nc5c(cc(c(c5C)S(=O)(=O)O)C)C)S(=O)(=O)O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Anthracenes
      • Subclass: Anthraquinones

List of PDB structures and/or AlphaFold models with target protein Q27686

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3QV6	Download	Experimental	e3qv6A2	TIM beta/alpha-barrel	LigPlot