Ligand name: 2-(4-((9S,10S,14S,Z)-18-(2-AMINO-2-OXOETHYL)-9-(CARBOXYMETHYL)-14-(NAPHTHALEN-1-YLMETHYL)-8,17,20-TRIOXO-7,16,19-TRIAZASPIRO[5.14]ICOS-11-EN-10-YL)PHENYL)MALONIC ACID
PDB ligand accession: S1S
DrugBank: n/a
PubChem: 52945407
ChEMBL: n/a
InChI Key: FYIJOFSDJMOTGX-HGOOHLDYSA-N
SMILES: c1ccc2c(c1)cccc2CC3CC=CC(C(C(=O)NC4(CCCCC4)C(=O)NC(C(=O)NC3)CC(=O)N)CC(=O)O)c5ccc(cc5)C(C(=O)O)C(=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 P62993

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2AOA	Download	Experimental	e2aoaA2 e2aoaB1	SH2 SH2	LigPlot
2AOB	Download	Experimental	e2aobA2 e2aobB2 e2aobC2 e2aobD2	SH2 SH2 SH2 SH2	LigPlot