Ligand name: FLAVIN-ADENINE DINUCLEOTIDE
PDB ligand accession: FAD
DrugBank: DB03147
PubChem: 643975
ChEMBL: CHEMBL1232653
InChI Key: VWWQXMAJTJZDQX-UYBVJOGSSA-N
SMILES: Cc1cc2c(cc1C)N(C3=NC(=O)NC(=O)C3=N2)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 drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P16435

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3QFS	Download	Experimental	e3qfsA3 e3qfsA4 e3qfsA2	NADPH-cytochrome p450 reductase helical insertion domain cradle loop barrel Ferredoxin reductase-like, C-terminal NADP-linked domain	LigPlot
3QE2	Download	Experimental	e3qe2A1 e3qe2A2 e3qe2A3 e3qe2A4 e3qe2B4 e3qe2B1 e3qe2B3 e3qe2B4	Ferredoxin reductase-like, C-terminal NADP-linked domain Flavodoxin-like NADPH-cytochrome p450 reductase helical insertion domain cradle loop barrel cradle loop barrel NADPH-cytochrome p450 reductase helical insertion domain Ferredoxin reductase-like, C-terminal NADP-linked domain cradle loop barrel	LigPlot
5EMN	Download	Experimental	e5emnA1 e5emnA2 e5emnA3 e5emnA4 e5emnB1 e5emnB2 e5emnB3 e5emnB4	cradle loop barrel Ferredoxin reductase-like, C-terminal NADP-linked domain Flavodoxin-like NADPH-cytochrome p450 reductase helical insertion domain NADPH-cytochrome p450 reductase helical insertion domain Flavodoxin-like Ferredoxin reductase-like, C-terminal NADP-linked domain cradle loop barrel	LigPlot
5FA6	Download	Experimental	e5fa6A1 e5fa6A3 e5fa6A4 e5fa6B1 e5fa6B2 e5fa6B3 e5fa6B4	NADPH-cytochrome p450 reductase helical insertion domain Ferredoxin reductase-like, C-terminal NADP-linked domain cradle loop barrel Flavodoxin-like NADPH-cytochrome p450 reductase helical insertion domain cradle loop barrel Ferredoxin reductase-like, C-terminal NADP-linked domain	LigPlot
3QFT	Download	Experimental	e3qftA3 e3qftA4 e3qftA2	NADPH-cytochrome p450 reductase helical insertion domain cradle loop barrel Ferredoxin reductase-like, C-terminal NADP-linked domain	LigPlot
3QFR	Download	Experimental	e3qfrA1 e3qfrA2 e3qfrA4 e3qfrB2 e3qfrB3 e3qfrB4	cradle loop barrel NADPH-cytochrome p450 reductase helical insertion domain Ferredoxin reductase-like, C-terminal NADP-linked domain cradle loop barrel Ferredoxin reductase-like, C-terminal NADP-linked domain NADPH-cytochrome p450 reductase helical insertion domain	LigPlot
3QFC	Download	Experimental	e3qfcA1 e3qfcA2 e3qfcA3 e3qfcA4 e3qfcB3 e3qfcB4 e3qfcB6	NADPH-cytochrome p450 reductase helical insertion domain cradle loop barrel Flavodoxin-like Ferredoxin reductase-like, C-terminal NADP-linked domain NADPH-cytochrome p450 reductase helical insertion domain cradle loop barrel Ferredoxin reductase-like, C-terminal NADP-linked domain	LigPlot