Ligand name: TETRADEC-13-YNOIC ACID - COA THIOESTER
PDB ligand accession: YNC
DrugBank: n/a
PubChem: 72183479
ChEMBL: n/a
InChI Key: YPDKCQHYDROOAS-QSGBVPJFSA-N
SMILES: CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CCCCCCCCCCCC#C)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Fatty Acyls
      • Subclass: Fatty acyl thioesters

List of PDB structures and/or AlphaFold models with target protein A5K1A2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2YNC	Download	Experimental	e2yncA2 e2yncA3 e2yncB2 e2yncB3 e2yncC2 e2yncC3	Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy	LigPlot