Ligand name: (2~{S},3~{R},4~{R})-4-(1~{H}-indol-3-ylsulfanyl)-3-methyl-2-[(2~{S},3~{S})-3-oxidanyl-1-oxidanylidene-butan-2-yl]-3,4-dihydro-2~{H}-pyrrole-5-carboxylic acid
PDB ligand accession: 6QR
DrugBank: n/a
PubChem: 137348512
ChEMBL: n/a
InChI Key: AXGRCXYYLJVWGE-PQRHUAHCSA-N
SMILES: CC1C(C(=NC1C(C=O)C(C)O)C(=O)O)Sc2c[nH]c3c2cccc3
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 I6Y9J2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5K69	Download	Experimental	e5k69A2 e5k69B1	L,D-transpeptidase catalytic domain-like L,D-transpeptidase catalytic domain-like	LigPlot