PDB ligand accession: PAD
DrugBank: DB04071
PubChem: 444170;5289104;
ChEMBL:
InChI Key: LFERELMXERXKKQ-KMXXXSRASA-N
SMILES: c1cc([nH+]c(c1)C(=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 |
---|---|---|---|---|---|
1ADC | Download | Experimental | e1adcA1 e1adcB2 e1adcA2 e1adcB1 e1adcB2 e1adcA2 | GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like Rossmann-like | LigPlot |
1A72 | Download | Experimental | e1a72A1 e1a72A2 | GroES-like Rossmann-like | LigPlot |