Ligand name: S-ADENOSYLMETHIONINE
PDB ligand accession: SAM
DrugBank: DB00118
PubChem: n/a
ChEMBL: CHEMBL1235831
InChI Key: MEFKEPWMEQBLKI-FCKMPRQPSA-N
SMILES: C[S+](CCC(C(=O)[O-])N)CC1C(C(C(O1)n2cnc3c2ncnc3N)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: 5'-deoxyribonucleosides
      • Subclass: 5'-deoxy-5'-thionucleosides

List of PDB structures and/or AlphaFold models with target protein Q0TTH1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4K39	Download	Experimental	e4k39A1	TIM beta/alpha-barrel	LigPlot
4K36	Download	Experimental	e4k36A1 e4k36B1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot
4K38	Download	Experimental	e4k38A1 e4k38B1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot
4K37	Download	Experimental	e4k37A1 e4k37B1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot