Ligand name: triptolide
PDB ligand accession: TLI
DrugBank: DB12025
PubChem: 107985
ChEMBL: CHEMBL463763
InChI Key: DFBIRQPKNDILPW-CIVMWXNOSA-N
SMILES: CC(C)C12C(O1)C3C4(O3)C5(CCC6=C(C5CC7C4(C2O)O7)COC6=O)C
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q9H773

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7MU5	Download	Experimental	e7mu5A1 e7mu5C1 e7mu5E1 e7mu5B1 e7mu5D1 e7mu5H1 e7mu5A1 e7mu5C1 e7mu5G1 e7mu5B1 e7mu5D1 e7mu5F1 e7mu5D1 e7mu5F1 e7mu5H1 e7mu5C1 e7mu5E1 e7mu5G1	all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases all-alpha NTP pyrophosphatases	LigPlot