Ligand name: (3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-{[(4-chlorophenyl)sulfanyl]methyl}pyrrolidin-3-ol
PDB ligand accession: 4CT
DrugBank: n/a
PubChem: 9952319
ChEMBL: CHEMBL1230265
InChI Key: MZZBHZOHYGEGEE-DOMZBBRYSA-N
SMILES: c1cc(ccc1SCC2CN(CC2O)Cc3c[nH]c4c3ncnc4N)Cl
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein F5B5W8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6X6R	Download	Experimental	e6x6rA2 e6x6rB2	ADP-ribosylation ADP-ribosylation	LigPlot