Ligand name: 1~{H}-indol-5-ylboronic acid
PDB ligand accession: JDN
DrugBank: n/a
PubChem: 2734361
ChEMBL: CHEMBL342460
InChI Key: VHADYSUJZAPXOW-UHFFFAOYSA-N
SMILES: B(c1ccc2c(c1)cc[nH]2)(O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: Indoles

List of PDB structures and/or AlphaFold models with target protein B1MDI3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6QQR	Download	Experimental	e6qqrB1	alpha/beta knot	LigPlot