Ligand name: NI-FE ACTIVE CENTER
PDB ligand accession: NFE
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: BWHVFYQLNHWUMU-UHFFFAOYSA-M
SMILES: C(=O)=[Fe](=C=O)(SO)S[Ni]
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic salts
    • Class: Organic metal salts
      • Subclass: Organic transition metal salts

List of PDB structures and/or AlphaFold models with target protein P21852

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1H2R	Download	Experimental	e1h2rL2 e1h2rL3 e1h2rL4	alpha-helical domain in nickel-iron hydrogenase, large subunit FAD-linked reductases, C-terminal domain-like FAD-linked reductases, C-terminal domain-like	LigPlot
1H2A	Download	Experimental	e1h2aL3 e1h2aL4	FAD-linked reductases, C-terminal domain-like FAD-linked reductases, C-terminal domain-like	LigPlot