Ligand name: DIHYDROFLAVINE-ADENINE DINUCLEOTIDE
PDB ligand accession: FDA
DrugBank: n/a
PubChem: 446013;5288205;101960651;
ChEMBL: n/a
InChI Key: YPZRHBJKEMOYQH-UYBVJOGSSA-N
SMILES: Cc1cc2c(cc1C)N(C3=C(N2)C(=O)NC(=O)N3)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: Flavin nucleotides
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q9S3V1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5G3U	Download	Experimental	e5g3uA1 e5g3uA2 e5g3uB1 e5g3uB2	FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like	LigPlot
5G3T	Download	Experimental	e5g3tA1 e5g3tA2 e5g3tB1 e5g3tB2 e5g3tC1 e5g3tC2 e5g3tD1 e5g3tD2	Rossmann-like FAD-linked reductases, C-terminal domain-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like	LigPlot
5G3S	Download	Experimental	e5g3sA1 e5g3sA2 e5g3sB1 e5g3sB2	Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like	LigPlot