Ligand name: Doxorubicin
PDB ligand accession: DM2
DrugBank: DB00997
InChI Key: AOJJSUZBOXZQNB-TZSSRYMLSA-N
SMILES: CC1C(C(CC(O1)OC2CC(Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(=O)CO)O)N)O
Drug action: inhibitor

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q02880

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
Q02880	Download	Predicted	Q02880_F1_nD5 Q02880_F1_nD3 Q02880_F1_nD4 Q02880_F1_nD2 Q02880_F1_nD1	a+b domain in type II DNA topoisomerase HAD domain-related HTH Ribosomal protein S5 domain 2-like ATPase domain of HSP90 chaperone/DNA topoisomerase II/histidine kinase-like
3QX3		Predicted	e3qx3A1 e3qx3B6 e3qx3A13 e3qx3B5 e3qx3A12 e3qx3B7 e3qx3B8 e3qx3A11
4G0U		Predicted	e4g0uA4 e4g0uB14 e4g0uB13 e4g0uA6 e4g0uB15 e4g0uA5 e4g0uA1 e4g0uB16
4G0V		Predicted	e4g0vA4 e4g0vB14 e4g0vB13 e4g0vA6 e4g0vB15 e4g0vA5 e4g0vA1 e4g0vB16
4G0W		Predicted	e4g0wA4 e4g0wB10 e4g0wB9 e4g0wA6 e4g0wB11 e4g0wA5 e4g0wA1 e4g0wB12
4J3N		Predicted	e4j3nB10 e4j3nA10 e4j3nB9 e4j3nA12 e4j3nB11 e4j3nA11 e4j3nB12 e4j3nA9
5GWI		Predicted	e5gwiA3 e5gwiB3 e5gwiA4 e5gwiB1 e5gwiA1 e5gwiB2 e5gwiB4 e5gwiA2
5GWJ		Predicted	e5gwjA2 e5gwjB4 e5gwjA4 e5gwjB1 e5gwjA3 e5gwjB2 e5gwjB3 e5gwjA1
5ZAD		Predicted	e5zadA1 e5zadB1 e5zadA4 e5zadB3 e5zadA2 e5zadB5 e5zadA5 e5zadB4 e5zadA3 e5zadB2
5ZEN		Predicted	e5zenA1 e5zenA3 e5zenA5 e5zenA2 e5zenA4
5ZQF		Predicted	e5zqfA3 e5zqfA4 e5zqfA2 e5zqfA1 e5zqfA5
5ZRF		Predicted	e5zrfB3 e5zrfA3 e5zrfB4 e5zrfA4 e5zrfB2 e5zrfA1 e5zrfB1 e5zrfA2