Ligand name: CO-(ADENIN-9-YL-PENTYL)-COBALAMIN
PDB ligand accession: COY
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: KWGNLVVAVJCVFN-OGKXECBZSA-N
SMILES: Cc1cc2c(cc1C)n(cn2)C3C(C(C(O3)CO)OP(=O)(O)OC(C)CNC(=O)CCC4(C(C5C6(C(C(C7=C(C8C(C(C9=CC1C(C(C2=C(C4[N-]5[Co+2](N12)(N89)(N76)CCCCCn1cnc2c1ncnc2N)C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Tetrapyrroles and derivatives
      • Subclass: Corrinoids

List of PDB structures and/or AlphaFold models with target protein P0AEJ6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3ABS	Download	Experimental	e3absA1 e3absB1 e3absC1 e3absD1	TIM beta/alpha-barrel B12-dependent dehydratase associated subunit TIM beta/alpha-barrel B12-dependent dehydratase associated subunit	LigPlot