PDB ligand accession: CND
DrugBank: DB03020
PubChem: 444215;5287958;
ChEMBL:
InChI Key: UINNILASBHZOTM-KMXXXSRASA-N
SMILES: c1c(c[nH+]cc1C(=O)N)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)O)O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Purine nucleotides
- Subclass: Purine nucleotide sugars
- Class: Purine nucleotides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1ADB | Download | Experimental | e1adbA1 e1adbB2 e1adbA2 e1adbB1 e1adbB2 e1adbA2 | GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like | LigPlot |