Ligand name: XANTHINE
PDB ligand accession: XAN
DrugBank: DB02134
PubChem: 1188;5280342;
ChEMBL: CHEMBL1424
InChI Key: LRFVTYWOQMYALW-UHFFFAOYSA-N
SMILES: c1[nH]c2c(n1)C(=O)NC(=O)N2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Imidazopyrimidines
      • Subclass: Purines and purine derivatives

List of PDB structures and/or AlphaFold models with target protein P80457

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3EUB	Download	Experimental	e3eubC3 e3eubC4 e3eubL3 e3eubL4 e3eubU3 e3eubU4 e3eub43 e3eub44	MocoBD/DmpA-related MocoBD/DmpA-related MocoBD/DmpA-related MocoBD/DmpA-related MocoBD/DmpA-related MocoBD/DmpA-related MocoBD/DmpA-related MocoBD/DmpA-related	LigPlot