Ligand name: [(1~{R})-1-[2-[[2,5-bis(chloranyl)phenyl]carbonylamino]ethanoylamino]-3-methyl-butyl]boronic acid
PDB ligand accession: 6V8
DrugBank: DB09570
PubChem: 25183872
ChEMBL: CHEMBL2141296
InChI Key: MXAYKZJJDUDWDS-LBPRGKRZSA-N
SMILES: B(C(CC(C)C)NC(=O)CNC(=O)c1cc(ccc1Cl)Cl)(O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzoic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein Q99436

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5LF7	Download	Experimental	e5lf7H1 e5lf7I1 e5lf7H1 e5lf7N1 e5lf7V1 e5lf7W1 e5lf7V1 e5lf7b1	Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C	LigPlot