Ligand name: ((2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXY-TETRAHYDROFURAN-2-YL)METHYL 5-((3AS,4S,6AR)-2-OXO-HEXAHYDRO-1H-THIENO[3,4-D]IMIDAZOL-4-YL)PENTYL HYDROGEN PHOSPHATE
PDB ligand accession: BTX
DrugBank: DB04651
PubChem: 6102809
ChEMBL: CHEMBL1231498
InChI Key: KBOGUFFJCBPJEH-SQGSUPJISA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OCCCCCC4C5C(CS4)NC(=O)N5)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 P06709

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2EWN	Download	Experimental	e2ewnA1 e2ewnA3 e2ewnB1 e2ewnB3	SH3 Class II aaRS and biotin synthetases SH3 Class II aaRS and biotin synthetases	LigPlot
4WF2	Download	Experimental	e4wf2A1	Class II aaRS and biotin synthetases	LigPlot