Ligand name: SINEFUNGIN
PDB ligand accession: SFG
DrugBank: DB01910
PubChem: 65482
ChEMBL: CHEMBL1214186
InChI Key: LMXOHSDXUQEUSF-YECHIGJVSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)CC(CCC(C(=O)O)N)N)O)O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: 5'-deoxyribonucleosides
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q86X55

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2Y1W	Download	Experimental	e2y1wA2 e2y1wB2 e2y1wC2 e2y1wD2	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot
5DXJ	Download	Experimental	e5dxjA1 e5dxjB1 e5dxjC2 e5dxjD1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot
5DX0	Download	Experimental	e5dx0A2 e5dx0B1 e5dx0C1 e5dx0D1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot
5DWQ	Download	Experimental	e5dwqA1 e5dwqB2 e5dwqC1 e5dwqD1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot
5DX8	Download	Experimental	e5dx8A2 e5dx8B2 e5dx8C2 e5dx8D2	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot
5DXA	Download	Experimental	e5dxaA2 e5dxaB2 e5dxaC2 e5dxaD1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot
5DX1	Download	Experimental	e5dx1A1 e5dx1B2 e5dx1C2 e5dx1D1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot