Ligand name: 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE
PDB ligand accession: AES
DrugBank: DB07347
PubChem: 1701
ChEMBL: CHEMBL1096339
InChI Key: MGSKVZWGBWPBTF-UHFFFAOYSA-N
SMILES: c1cc(ccc1CCN)S(=O)(=O)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Phenethylamines

List of PDB structures and/or AlphaFold models with target protein Q60187

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3B2Q	Download	Experimental	e3b2qB7	cradle loop barrel	LigPlot
3SSA	Download	Experimental	e3ssaA6 e3ssaA2	P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase	LigPlot
3TGW	Download	Experimental	e3tgwB6	cradle loop barrel	LigPlot
3TIV	Download	Experimental	e3tivB12	cradle loop barrel	LigPlot
3EIU	Download	Experimental	e3eiuB7	cradle loop barrel	LigPlot