Ligand name: methyl 7-chloro-6,7,8-trideoxy-6-{[(4S,5aS,8S,8aR)-4-(2-methylpropyl)octahydro-2H-oxepino[2,3-c]pyrrole-8-carbonyl]amino}-1-thio-L-threo-alpha-D-galacto-octopyranoside
PDB ligand accession: 6IF
DrugBank: n/a
PubChem: 156613433
ChEMBL: CHEMBL5499733
InChI Key: JPCLUJPDWMBCAA-SUTQZAMLSA-N
SMILES: CC(C)CC1CCOC2C(C1)CNC2C(=O)NC(C3C(C(C(C(O3)SC)O)O)O)C(C)Cl
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 P80339

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7RQ9	Download	Experimental	e7rq9151 e7rq9251	Rubredoxin-like Rubredoxin-like	LigPlot