Ligand name: (2R)-2-AMINO-6-({[(2S,3R)-3-METHYLPYRROLIDIN-2-YL]CARBONYL}AMINO)HEXANOYL [(2S,3R,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL]METHYL HYDROGEN (R)-PHOSPHATE
PDB ligand accession: YLY
DrugBank: n/a
PubChem: 16741244
ChEMBL: n/a
InChI Key: MLNCIGVKMPQTPJ-CWEHIGOWSA-N
SMILES: CC1CCNC1C(=O)NCCCCC(C(=O)OP(=O)(O)OCC2C(C(C(O2)n3cnc4c3ncnc4N)O)O)N
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 Q8PWY1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2Q7H	Download	Experimental	e2q7hA1	Class II aaRS and biotin synthetases	LigPlot
2ZIM	Download	Experimental	e2zimA1	Class II aaRS and biotin synthetases	LigPlot