Ligand name: Adenosine Diphosphate (Hydroxymethyl)pyrrolidine monoalcohol
PDB ligand accession: A3R
DrugBank: n/a
PubChem: 10951514
ChEMBL: n/a
InChI Key: PHEYQOBMMIEFLO-IBCGMDAMSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC4CC(CN4)O)O)O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Purine nucleotides
      • Subclass: Purine ribonucleotides

List of PDB structures and/or AlphaFold models with target protein H3BCW1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6HH5	Download	Experimental	e6hh5A1 e6hh5B1	ADP-ribosylglycohydrolase ADP-ribosylglycohydrolase	LigPlot