Ligand name: 1,4-DIHYDROXY-5,8-BIS({2-[(2-HYDROXYETHYL)AMINO]ETHYL}AMINO)-9,10-ANTHRACENEDIONE
PDB ligand accession: MIX
DrugBank: DB01204
PubChem: 4212
ChEMBL: CHEMBL58
InChI Key: KKZJGLLVHKMTCM-UHFFFAOYSA-N
SMILES: c1cc(c2c(c1NCCNCCO)C(=O)c3c(ccc(c3C2=O)O)O)NCCNCCO
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 Q9UNQ0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7NFD	Download	Experimental	e7nfdA1 e7nfdB1	Type II ABC exporter transmembrane domain fold Type II ABC exporter transmembrane domain fold	LigPlot
6VXI	Download	Experimental	e6vxiA1 e6vxiB2	Type II ABC exporter transmembrane domain fold Type II ABC exporter transmembrane domain fold	LigPlot