Ligand name: 3-({2-[(2R)-2-carbamoyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-2-oxoethyl}sulfanyl)propanoic acid
PDB ligand accession: Q5G
DrugBank: n/a
PubChem: 32416127
ChEMBL: n/a
InChI Key: SDNYVGUVTOZEQL-LLVKDONJSA-N
SMILES: c1ccc2c(c1)N(CC(O2)C(=O)N)C(=O)CSCCC(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzoxazines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein A6V1E4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6UEG	Download	Experimental	e6uegA1 e6uegB1 e6uegB1 e6uegC1 e6uegD1 e6uegE1 e6uegE1 e6uegF1 e6uegD1 e6uegF1	Single-stranded left-handed beta-helix Single-stranded left-handed beta-helix Single-stranded left-handed beta-helix Single-stranded left-handed beta-helix Single-stranded left-handed beta-helix Single-stranded left-handed beta-helix Single-stranded left-handed beta-helix Single-stranded left-handed beta-helix Single-stranded left-handed beta-helix Single-stranded left-handed beta-helix	LigPlot