Ligand name: {N-(4-{bis[(pyridin-2-yl-kappaN)methyl]amino-kappaN}butyl)-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide}iron(3+)
PDB ligand accession: KM3
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: BLSJCACNFKSTBA-LTWAPREQSA-N
SMILES: c1cc[n+]2c(c1)C[N+]3([Fe]2[n+]4ccccc4C3)CCCCNC(=O)CCCCC5C6C(CS5)NC(=O)N6
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Biotin and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P22629

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6VP3	Download	Experimental	e6vp3A1 e6vp3D1 e6vp3B1 e6vp3C1	Lipocalins/Streptavidin Lipocalins/Streptavidin Lipocalins/Streptavidin Lipocalins/Streptavidin	LigPlot
6VP2	Download	Experimental	e6vp2A1 e6vp2D1 e6vp2B1 e6vp2C1	Lipocalins/Streptavidin Lipocalins/Streptavidin Lipocalins/Streptavidin Lipocalins/Streptavidin	LigPlot
6VOZ	Download	Experimental	e6vozA1	Lipocalins/Streptavidin	LigPlot
6VOB	Download	Experimental	e6vobA1	Lipocalins/Streptavidin	LigPlot
6VO9	Download	Experimental	e6vo9A1	Lipocalins/Streptavidin	LigPlot
7KBY	Download	Experimental	e7kbyA1	Lipocalins/Streptavidin	LigPlot
6VP1	Download	Experimental	e6vp1A1 e6vp1D1 e6vp1B1 e6vp1C1	Lipocalins/Streptavidin Lipocalins/Streptavidin Lipocalins/Streptavidin Lipocalins/Streptavidin	LigPlot
7KBZ	Download	Experimental	e7kbzA1 e7kbzD1 e7kbzB1 e7kbzC1	Lipocalins/Streptavidin Lipocalins/Streptavidin Lipocalins/Streptavidin Lipocalins/Streptavidin	LigPlot