Ligand name: 1-deoxy-5-O-phosphono-1-(3,3,4,5-tetramethyl-9,11-dioxo-2,3,8,9,10,11-hexahydro-7H-quinolino[1,8-fg]pteridin-12-ium-7-y l)-D-ribitol
PDB ligand accession: 4LU
DrugBank: n/a
PubChem: 91828263
ChEMBL: n/a
InChI Key: KOUJZPGFPGLHCZ-IYOUNJFTSA-O
SMILES: Cc1cc2c3c(c1C)C(CC=[N+]3C4=C(N2CC(C(C(COP(=O)(O)O)O)O)O)NC(=O)NC4=O)(C)C
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 A2QHE5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6EV4	Download	Experimental	e6ev4A1 e6ev4A2	Alpha-lytic protease prodomain-like cradle loop barrel	LigPlot
6EV7	Download	Experimental	e6ev7A1 e6ev7A3	cradle loop barrel Alpha-lytic protease prodomain-like	LigPlot
6R2T	Download	Experimental	e6r2tA2 e6r2tA3	cradle loop barrel Alpha-lytic protease prodomain-like	LigPlot
6EVC	Download	Experimental	e6evcA1 e6evcA3	cradle loop barrel Alpha-lytic protease prodomain-like	LigPlot
4ZA7	Download	Experimental	e4za7A1 e4za7A3	Alpha-lytic protease prodomain-like cradle loop barrel	LigPlot
4ZA4	Download	Experimental	e4za4A2 e4za4A3	Alpha-lytic protease prodomain-like cradle loop barrel	LigPlot
6EV3	Download	Experimental	e6ev3A1 e6ev3A2	Alpha-lytic protease prodomain-like cradle loop barrel	LigPlot
4ZA8	Download	Experimental	e4za8A2 e4za8A3	cradle loop barrel Alpha-lytic protease prodomain-like	LigPlot
4ZAB	Download	Experimental	e4zabA1 e4zabA2	Alpha-lytic protease prodomain-like cradle loop barrel	LigPlot
8OEO	Download	Experimental	e8oeoA1 e8oeoA3	Alpha-lytic protease prodomain-like cradle loop barrel	LigPlot
6EVB	Download	Experimental	e6evbA1 e6evbA3	Alpha-lytic protease prodomain-like cradle loop barrel	LigPlot
4ZA5	Download	Experimental	e4za5A1 e4za5A2	cradle loop barrel Alpha-lytic protease prodomain-like	LigPlot
4ZAA	Download	Experimental	e4zaaA1 e4zaaA2	Alpha-lytic protease prodomain-like cradle loop barrel	LigPlot
8OEH	Download	Experimental	e8oehA1 e8oehA3	cradle loop barrel Alpha-lytic protease prodomain-like	LigPlot
7NF3	Download	Experimental	e7nf3A1 e7nf3A2	cradle loop barrel Alpha-lytic protease prodomain-like	LigPlot