Ligand name: Sinapoyl coenzyme A
PDB ligand accession: SPF
DrugBank: DB03179
InChI Key: HJGDVDUGXUSOGA-ADTMLPBESA-N
SMILES: CC1(C(C1(C(=O)NCCC(=O)NCCSC(=O)C=Cc2cc(c(c(c2)OC)O)OC)O)OP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)O)OP(=O)(O)O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Purine nucleotides
      • Subclass: Purine ribonucleotides

List of PDB structures and/or AlphaFold models with target protein Q86VU5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
Q86VU5	Download	Predicted	Q86VU5_F1_nD1	Rossmann-like
2AVD		Predicted	e2avdA1 e2avdB1