Ligand name: N-[2-(acetylamino)ethyl]-N~3~-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alaninamide
PDB ligand accession: 9EF
DrugBank: n/a
PubChem: 137348808
ChEMBL: n/a
InChI Key: GTANJSAWPNEGPZ-NSHDSACASA-N
SMILES: CC(=O)NCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(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 Q76KY5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8H6S	Download	Experimental	e8h6sA1 e8h6sA2 e8h6sC1 e8h6sB1 e8h6sB2 e8h6sD1	Flavodoxin-like Alpha-beta plaits ACP-like Alpha-beta plaits Flavodoxin-like ACP-like	LigPlot
7F2R	Download	Experimental	e7f2rA1 e7f2rA2 e7f2rB1 e7f2rC1 e7f2rC2 e7f2rD1	Flavodoxin-like Alpha-beta plaits ACP-like Flavodoxin-like Alpha-beta plaits ACP-like	LigPlot