Ligand name: (4R,5S)-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-3-({(3S,5S)-5-[(sulfamoylamino)methyl]pyrrolidin-3-yl}sulfanyl)-4,5-dihydro-1H-pyrrole-2-carboxylic acid
PDB ligand accession: 4J6
DrugBank: n/a
PubChem: 137348248
ChEMBL: n/a
InChI Key: QJKQOMNNBOTMCR-PQTSNVLCSA-N
SMILES: CC1C(NC(=C1SC2CC(NC2)CNS(=O)(=O)N)C(=O)O)C(C=O)C(C)O

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of proteins that are targets for 4J6

#	DrugDomain Data	UniProt Accession	Protein name	Drug Action	Affinity data
1	Q6XEC0_4J6	Q6XEC0	Beta-lactamase OXA-48 (EC	n/a
2	Q5QT35_4J6	Q5QT35	Beta-lactamase	n/a
3	Q8RLA6_4J6	Q8RLA6	Carbapenem-hydrolyzing beta-lactamase OXA-40	n/a
4	I6YCI1_4J6	I6YCI1	beta-lactamase (EC 3.5.2.6)	n/a