Ligand name: 5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-D]IMIDAZOL-6-YL)PENTANAL
PDB ligand accession: BTI
DrugBank: DB07497
PubChem: 11840927
ChEMBL: n/a
InChI Key: ARDNWGMSCXSPBF-CIUDSAMLSA-N
SMILES: C1C2C(C(S1)CCCCC=O)NC(=O)N2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Biotin and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q9I299

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3U9S	Download	Experimental	e3u9sA1 e3u9sA2 e3u9sA5 e3u9sF6 e3u9sH5	Protein kinase/SAICAR synthase/ATP-grasp alpha/beta-Hammerhead/Barrel-sandwich hybrid alpha/beta-Hammerhead/Barrel-sandwich hybrid ClpP/crotonase ClpP/crotonase	LigPlot