Ligand name: [(2~{S})-5-[[(2~{R})-1-(2-hydroxy-2-oxoethylamino)-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-1-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]azanium
PDB ligand accession: VDW
DrugBank: n/a
PubChem: 444462;446684;87774813;
ChEMBL: n/a
InChI Key: RWSXRVCMGQZWBV-WDSKDSINSA-O
SMILES: C(CC(=O)NC(CS)C(=O)NCC(=O)O)C(C(=O)O)[NH3+]
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein Q9ZS17

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7ODM	Download	Experimental	e7odmAAA1 e7odmAAA2	Thioredoxin-like Repetitive alpha hairpins	LigPlot
6TK8	Download	Experimental	e6tk8AAA1	Thioredoxin-like	LigPlot