Ligand name: (3S)-9-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid
PDB ligand accession: LFX
DrugBank: DB01137
PubChem: 149096;6956357;
ChEMBL: CHEMBL33
InChI Key: GSDSWSVVBLHKDQ-JTQLQIEISA-N
SMILES: CC1COc2c3c(cc(c2N4CCN(CC4)C)F)C(=O)C(=CN31)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Quinolines and derivatives
      • Subclass: Quinoline carboxylic acids

List of PDB structures and/or AlphaFold models with target protein R4YHS8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5EIX	Download	Experimental	e5eixA2 e5eixA4 e5eixG3 e5eixB3 e5eixB4 e5eixJ2 e5eixA4 e5eixG1 e5eixG3 e5eixB4 e5eixJ2 e5eixJ3	HAD domain-related HTH HTH HAD domain-related HTH HTH HTH HAD domain-related HTH HTH HTH HAD domain-related	LigPlot