Ligand name: [(1S)-1-{[(2-benzylphenyl)carbonyl]amino}ethyl](trihydroxy)borate(1-)
PDB ligand accession: EWB
DrugBank: n/a
PubChem: 49843458
ChEMBL: n/a
InChI Key: KXUAFLYMMJHXHZ-GFCCVEGCSA-N
SMILES: [B-](C(C)NC(=O)c1ccccc1Cc2ccccc2)(O)(O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P39045

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2XK1	Download	Experimental	e2xk1A1 e2xk1A2 e2xk1A3 e2xk1A4 e2xk1C1 e2xk1B2 e2xk1B3 e2xk1B4 e2xk1C2 e2xk1C3 e2xk1C4 e2xk1B1 e2xk1D2 e2xk1D3 e2xk1D4	Inserted beta sandwich domain in Dac-like proteins alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like DTD-like Inserted beta sandwich domain in Dac-like proteins alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like DTD-like alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like DTD-like Inserted beta sandwich domain in Dac-like proteins alpha-helical domain in beta-lactamase/transpeptidase-like proteins Profilin-like DTD-like	LigPlot