PDB ligand accession: ATP
DrugBank: DB00171
PubChem:
ChEMBL:
InChI Key: ZKHQWZAMYRWXGA-KQYNXXCUSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)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 |
|---|---|---|---|---|---|
| 6UDO | Download | Experimental | e6udoA1 e6udoF1 e6udoB1 e6udoE1 e6udoC1 e6udoH1 e6udoD2 e6udoG2 | CBS-domain CBS-domain CBS-domain CBS-domain CBS-domain CBS-domain CBS-domain CBS-domain | LigPlot |
| 6UC2 | Download | Experimental | e6uc2A2 e6uc2F2 e6uc2B1 e6uc2E2 e6uc2C1 e6uc2H2 e6uc2D2 e6uc2G2 | CBS-domain CBS-domain CBS-domain CBS-domain CBS-domain CBS-domain CBS-domain CBS-domain | LigPlot |
| 6UA2 | Download | Experimental | e6ua2A1 e6ua2F1 e6ua2B1 e6ua2E1 e6ua2C1 e6ua2H1 e6ua2D1 e6ua2G1 e6ua2G1 | 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 TIM beta/alpha-barrel | LigPlot |
| 6U9O | Download | Experimental | e6u9oA1 e6u9oF1 e6u9oB1 e6u9oE1 e6u9oC1 e6u9oH1 e6u9oD1 e6u9oG1 | 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 |
| 6U8R | Download | Experimental | e6u8rA1 e6u8rB1 e6u8rC1 e6u8rD1 e6u8rE1 e6u8rF1 e6u8rG1 e6u8rH1 | 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 |
| 6UA4 | Download | Experimental | e6ua4A1 e6ua4F1 e6ua4B1 e6ua4E1 e6ua4C1 e6ua4D1 e6ua4G1 e6ua4G1 e6ua4C1 e6ua4H1 | 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 TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 6UAJ | Download | Experimental | e6uajA1 e6uajF1 e6uajB1 e6uajE1 e6uajC1 e6uajH1 e6uajD1 e6uajG1 | 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 |
| 6U8N | Download | Experimental | e6u8nA1 e6u8nB1 e6u8nC1 e6u8nD1 e6u8nE1 e6u8nF1 e6u8nG1 e6u8nH1 | 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 |
| 6UDQ | Download | Experimental | e6udqA2 e6udqE1 e6udqB1 e6udqF1 e6udqC1 e6udqG1 e6udqD2 e6udqH1 | CBS-domain TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel CBS-domain TIM beta/alpha-barrel | LigPlot |