Ligand name: 5'-[(S)-(3-AMINOPROPYL)(METHYL)-LAMBDA~4~-SULFANYL]-5'-DEOXYADENOSINE
PDB ligand accession: S4M
DrugBank: n/a
PubChem: 49867629
ChEMBL: n/a
InChI Key: KIZZALRCMBIHBH-IDTAVKCVSA-N
SMILES: CS(CCCN)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: None

List of PDB structures and/or AlphaFold models with target protein Q4DA73

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4YV1	Download	Experimental	e4yv1A1 e4yv1A2 e4yv1B1 e4yv1B2 e4yv1C1 e4yv1C2 e4yv1D1 e4yv1D2	Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like Rossmann-like Spermidine synthase tetramerisation domain Spermidine synthase tetramerisation domain Rossmann-like	LigPlot
4YV0	Download	Experimental	e4yv0A1 e4yv0A2 e4yv0B1 e4yv0B2 e4yv0C1 e4yv0C2 e4yv0D1 e4yv0D2	Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain Spermidine synthase tetramerisation domain Rossmann-like	LigPlot
5Y4P	Download	Experimental	e5y4pA1 e5y4pA2 e5y4pB1 e5y4pB2 e5y4pC1 e5y4pC2 e5y4pD1 e5y4pD2	Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain Spermidine synthase tetramerisation domain Rossmann-like	LigPlot
4YUV	Download	Experimental	e4yuvA1 e4yuvA2 e4yuvB1 e4yuvB2	Rossmann-like Spermidine synthase tetramerisation domain Spermidine synthase tetramerisation domain Rossmann-like	LigPlot
4YUZ	Download	Experimental	e4yuzA1 e4yuzA2 e4yuzB1 e4yuzB2 e4yuzC1 e4yuzC2 e4yuzD1 e4yuzD2	Spermidine synthase tetramerisation domain Rossmann-like Rossmann-like Spermidine synthase tetramerisation domain Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like	LigPlot
4YUW	Download	Experimental	e4yuwA1 e4yuwA2 e4yuwB1 e4yuwB2	Spermidine synthase tetramerisation domain Rossmann-like Rossmann-like Spermidine synthase tetramerisation domain	LigPlot
5B1S	Download	Experimental	e5b1sA1 e5b1sA2 e5b1sB1 e5b1sB2 e5b1sC1 e5b1sC2 e5b1sD1 e5b1sD2	Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like Rossmann-like Spermidine synthase tetramerisation domain Spermidine synthase tetramerisation domain Rossmann-like	LigPlot
4YV2	Download	Experimental	e4yv2A1 e4yv2A2 e4yv2B1 e4yv2B2	Rossmann-like Spermidine synthase tetramerisation domain Spermidine synthase tetramerisation domain Rossmann-like	LigPlot
4YUX	Download	Experimental	e4yuxA1 e4yuxA2 e4yuxB1 e4yuxB2	Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain	LigPlot
5Y4Q	Download	Experimental	e5y4qA1 e5y4qA2 e5y4qB1 e5y4qB2 e5y4qC1 e5y4qC2 e5y4qD1 e5y4qD2	Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain Spermidine synthase tetramerisation domain Rossmann-like	LigPlot
4YUY	Download	Experimental	e4yuyA1 e4yuyA2 e4yuyB1 e4yuyB2	Spermidine synthase tetramerisation domain Rossmann-like Spermidine synthase tetramerisation domain Rossmann-like	LigPlot