Ligand name: LIPOIC ACID
PDB ligand accession: LPA
DrugBank: DB00166
PubChem: 6112
ChEMBL: CHEMBL134342
InChI Key: AGBQKNBQESQNJD-SSDOTTSWSA-N
SMILES: C1CSSC1CCCCC(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Dithiolanes
      • Subclass: Lipoic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein Q838C1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5IJ6	Download	Experimental	e5ij6A1 e5ij6A2	Class II aaRS and biotin synthetases FAD-linked reductases, C-terminal domain-like	LigPlot