PDB ligand accession: GTP
DrugBank: DB04137
PubChem: 6830;5280317;135398633;
ChEMBL:
InChI Key: XKMLYUALXHKNFT-UUOKFMHZSA-N
SMILES: c1nc2c(n1C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(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 |
---|---|---|---|---|---|
7RFE | Download | Experimental | e7rfeA1 e7rfeA2 e7rfeB1 e7rfeB2 e7rfeC1 e7rfeC2 e7rfeD1 e7rfeD2 e7rfeE1 e7rfeE2 e7rfeF1 e7rfeF2 e7rfeG1 e7rfeG2 e7rfeH1 e7rfeH2 | CBS-domain TIM beta/alpha-barrel TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel CBS-domain CBS-domain TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel TIM beta/alpha-barrel CBS-domain CBS-domain TIM beta/alpha-barrel | LigPlot |
7RFG | Download | Experimental | e7rfgA1 e7rfgA2 e7rfgB1 e7rfgB2 e7rfgC1 e7rfgC2 e7rfgD1 e7rfgD2 e7rfgE1 e7rfgE2 e7rfgF1 e7rfgF2 e7rfgG1 e7rfgG2 e7rfgH1 e7rfgH2 | TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel CBS-domain CBS-domain TIM beta/alpha-barrel TIM beta/alpha-barrel CBS-domain CBS-domain TIM beta/alpha-barrel TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel CBS-domain CBS-domain TIM beta/alpha-barrel | LigPlot |
7RFI | Download | Experimental | e7rfiA1 e7rfiB1 e7rfiC1 e7rfiD1 e7rfiE1 e7rfiF1 e7rfiG1 e7rfiH1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
7RGQ | Download | Experimental | e7rgqA1 e7rgqA2 e7rgqH1 e7rgqB1 e7rgqB2 e7rgqC1 e7rgqC2 e7rgqD1 e7rgqD2 e7rgqE1 e7rgqE2 e7rgqD1 e7rgqE1 e7rgqE2 e7rgqF1 e7rgqF2 e7rgqB1 e7rgqG1 e7rgqG2 e7rgqH1 e7rgqH2 | TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel TIM beta/alpha-barrel CBS-domain CBS-domain TIM beta/alpha-barrel TIM beta/alpha-barrel CBS-domain CBS-domain TIM beta/alpha-barrel TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel CBS-domain | LigPlot |