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 A4X3Q0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6RYZ	Download	Experimental	e6ryzA1 e6ryzA2 e6ryzC2 e6ryzB1 e6ryzA2 e6ryzB2 e6ryzC1	cradle loop barrel Bacterial fluorinating enzyme, N-terminal domain Bacterial fluorinating enzyme, N-terminal domain cradle loop barrel Bacterial fluorinating enzyme, N-terminal domain Bacterial fluorinating enzyme, N-terminal domain cradle loop barrel	LigPlot
2Q6O	Download	Experimental	e2q6oA2 e2q6oB2	Bacterial fluorinating enzyme, N-terminal domain Bacterial fluorinating enzyme, N-terminal domain	LigPlot