Ligand name: GEMCITABINE
PDB ligand accession: GEO
DrugBank: DB00441
PubChem: 60750
ChEMBL: CHEMBL888
InChI Key: SDUQYLNIPVEERB-QPPQHZFASA-N
SMILES: C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)(F)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Pyrimidine nucleosides
      • Subclass: Pyrimidine 2'-deoxyribonucleosides

List of PDB structures and/or AlphaFold models with target protein Q9KPL5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4PD5	Download	Experimental	e4pd5A1	Concentrative nucleoside transporter	LigPlot