Ligand name: azanylidene-[4-[[(1~{S},2~{R},3~{R},4~{R},5~{S},6~{S},7~{S})-2-(hydroxymethyl)-3,4,5-tris(oxidanyl)-7-bicyclo[4.1.0]heptanyl]carbonylamino]butylimino]azanium
PDB ligand accession: 8P5
DrugBank: n/a
PubChem: 124219469
ChEMBL: n/a
InChI Key: AGQBRQFVJQUDGP-MQOZHFKUSA-O
SMILES: C(CCN=[N+]=N)CNC(=O)C1C2C1C(C(C(C2CO)O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Cyclopropanecarboxylic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein Q08638

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5N6S	Download	Experimental	e5n6sA1 e5n6sB1 e5n6sC1 e5n6sD1	TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot