Ligand name: 1~{H}-indol-6-ylboronic acid
PDB ligand accession: JB8
DrugBank: n/a
PubChem: 2763205
ChEMBL: CHEMBL4071778
InChI Key: ZVMHOIWRCCZGPZ-UHFFFAOYSA-N
SMILES: B(c1ccc2cc[nH]c2c1)(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
6QOU	Download	Experimental	e6qouA1 e6qouB1	alpha/beta knot alpha/beta knot	LigPlot