Ligand name: 2-[(2~{S},6~{R})-2,6-dimethylpiperidin-1-yl]-8-nitro-6-(trifluoromethyl)-1,3-benzoxazin-4-one
PDB ligand accession: G1H
DrugBank: n/a
PubChem: 137349381
ChEMBL: n/a
InChI Key: AFGNZAKVTALLAQ-DTORHVGOSA-N
SMILES: CC1CCCC(N1C2=NC(=O)c3cc(cc(c3O2)[N+](=O)[O-])C(F)(F)F)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzoxazines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P9WJF1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6HF0	Download	Experimental	e6hf0A1 e6hf0A2 e6hf0B1 e6hf0B2	Alpha-beta plaits FAD-binding domain-like FAD-binding domain-like Alpha-beta plaits	LigPlot