Ligand name: Patupilone
PDB ligand accession: EPB
DrugBank: DB03010
InChI Key: QXRSDHAAWVKZLJ-PVYNADRNSA-N
SMILES: Cc1nc(cs1)C=C(C)C2CC3C(O3)(CCCC(C(C(C(=O)C(C(CC(=O)O2)O)(C)C)C)O)C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Macrolides and analogues
      • Subclass: Epothilones and analogues

List of PDB structures and/or AlphaFold models with target protein Q71U36

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
Q71U36	Download	Predicted	Q71U36_F1_nD2 Q71U36_F1_nD1	Bacillus chorismate mutase-like Rossmann-like
5JCO		Predicted	e5jcoH2 e5jcoE1 e5jcoF1 e5jcoA1 e5jcoB2 e5jcoG2 e5jcoH1 e5jcoE2 e5jcoF2 e5jcoA2 e5jcoB1 e5jcoG1