Ligand name: 4-[2-[4-(aminomethyl)phenyl]phenyl]piperazin-2-one
PDB ligand accession: EVU
DrugBank: n/a
PubChem: 146025959
ChEMBL: n/a
InChI Key: PENSDGIWXYUOBB-UHFFFAOYSA-N
SMILES: c1ccc(c(c1)c2ccc(cc2)CN)N3CCNC(=O)C3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein P0AA25

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6LUR	Download	Experimental	e6lurB1 e6lurB2 e6lurF2 e6lurA1 e6lurA2 e6lurC1 e6lurC2 e6lurD1 e6lurA1 e6lurE2	Alpha-beta plaits Thioredoxin-like Thioredoxin-like Alpha-beta plaits Thioredoxin-like Alpha-beta plaits Thioredoxin-like Thioredoxin-like Alpha-beta plaits Alpha-beta plaits	LigPlot