Ligand name: N-propargylglycine-modified flavin adenine dinucleotide
PDB ligand accession: P5F
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: IRSTVKNHNHEQIM-RDJFLKOLSA-N
SMILES: CC1=CC2=[N](C3=C(C(=O)NC(=O)N3)[N](=C2C=C1C)C=CC=NCC(=O)O)CC(C(C(COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)n5cnc6c5ncnc6N)O)O)O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Purine nucleotides
      • Subclass: Purine ribonucleotides

List of PDB structures and/or AlphaFold models with target protein Q746X3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4NMF	Download	Experimental	e4nmfA3 e4nmfB3	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot
4NME	Download	Experimental	e4nmeA3 e4nmeB3	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot