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 P00778

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3PRO	Download	Experimental	e3proA1 e3proC2 e3proB1 e3proD2	cradle loop barrel Alpha-lytic protease prodomain-like cradle loop barrel Alpha-lytic protease prodomain-like	LigPlot