Ligand name: Coenzyme B
PDB ligand accession: TP7
DrugBank: n/a
PubChem: 5462265
ChEMBL: n/a
InChI Key: JBJSVEVEEGOEBZ-SCZZXKLOSA-N
SMILES: CC(C(C(=O)O)NC(=O)CCCCCCS)OP(=O)(O)O
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 D1JBK4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3SQG	Download	Experimental	e3sqgA1 e3sqgA2 e3sqgD1 e3sqgE1 e3sqgG1 e3sqgH1	Alpha-beta plaits Methyl-coenzyme M reductase alpha and beta chain-C Methyl-coenzyme M reductase alpha and beta chain-C Methyl-coenzyme M reductase alpha and beta chain-C Methyl-coenzyme M reductase alpha and beta chain-C Methyl-coenzyme M reductase alpha and beta chain-C	LigPlot