PDB ligand accession: GSP
DrugBank: DB01864
PubChem: 37792;444121;5280465;135398675;135450576;
ChEMBL:
InChI Key: XOFLBQFBSOEHOG-UUOKFMHZSA-N
SMILES: c1nc2c(n1C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=S)(O)O)O)O)N=C(NC2=O)N
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 |
---|---|---|---|---|---|
3M89 | Download | Experimental | e3m89A1 | Rossmann-like | LigPlot |
2XKA | Download | Experimental | e2xkaA2 e2xkaB5 e2xkaA1 e2xkaA2 e2xkaB6 e2xkaC2 e2xkaD5 e2xkaC1 e2xkaE5 e2xkaD6 e2xkaE6 e2xkaF1 e2xkaF6 e2xkaG1 | Rossmann-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like | LigPlot |