PDB ligand accession: DCA
DrugBank: DB01829
PubChem:
ChEMBL: n/a
InChI Key: ILWZMFJBPIYQKW-IBOSZNHHSA-N
SMILES: CCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Purine nucleotides
- Subclass: Purine ribonucleotides
- Class: Purine nucleotides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2XAT | Download | Experimental | e2xatA1 | Single-stranded left-handed beta-helix | LigPlot |