UniProt Q9AIU7
Q9AIU7
Q9AIU7 (UniProt Q9AIU7): 12 experimental structures and 1 predicted model on GenesisL1, 3 ligands bound. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- Q9AIU7
- Experimental structures
- 12
- Predicted models
- 1
- Ligands
- 3
Structures
13 records of Q9AIU7 in the MolNFT archive: 12 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 3JSL | Crystal structure of the adenylation domain of NAD+-dependent DNA ligase from Staphylococcus aureus | x-ray diffraction | A, B | — | — |
| 3JSL | Crystal structure of the adenylation domain of NAD+- dependent DNA ligase from staphylococcus aureus | x-ray diffraction | A, B | — | — |
| 3JSN | Crystal structure of the adenylation domain of NAD+-dependent DNA ligase from Staphylococcus aureus | x-ray diffraction | A | — | — |
| 3JSN | Crystal structure of the adenylation domain of NAD+- dependent DNA ligase from staphylococcus aureus | x-ray diffraction | A | — | — |
| 4CC5 | Fragment-Based Discovery of 6 Azaindazoles As Inhibitors of Bacterial DNA Ligase | x-ray diffraction | A | — | — |
| 4CC5 | Fragment-based discovery of 6 azaindazoles as inhibitors of bacterial DNA ligase | x-ray diffraction | A | — | — |
| 4CC6 | Fragment-Based Discovery of 6 Azaindazoles As Inhibitors of Bacterial DNA Ligase | x-ray diffraction | A | — | — |
| 4CC6 | Fragment-based discovery of 6 azaindazoles as inhibitors of bacterial DNA ligase | x-ray diffraction | A | — | — |
| 5FPO | Structure of Bacterial DNA Ligase with small-molecule ligand 1H- indazol-7-amine (AT4213) in an… | x-ray diffraction | A | 10L | — |
| 5FPO | Structure of bacterial DNA ligase with small-molecule ligand 1H-indazol-7-amine (AT4213) in an… | x-ray diffraction | A | — | — |
| 5FPR | Structure of Bacterial DNA Ligase with small-molecule ligand pyrimidin-2-amine (AT371) in an… | x-ray diffraction | A | SO4, LGA | — |
| 5FPR | Structure of bacterial DNA ligase with small-molecule ligand pyrimidin-2-amine (AT371) in an… | x-ray diffraction | A | — | — |
| Q9AIU7 | AlphaFold monomer V2.0 prediction for DNA ligase (Q9AIU7) | predicted | A | — | — |
Ligands
Experiment against prediction
- 4CC6 chain A against the predicted model Q9AIU7: TM-score 0.98, RMSD 1.04 Å
- 4CC6 chain A against the predicted model Q9AIU7: TM-score 0.98, RMSD 1.04 Å
- 4CC5 chain A against the predicted model Q9AIU7: TM-score 0.98, RMSD 1.07 Å
- 4CC5 chain A against the predicted model Q9AIU7: TM-score 0.98, RMSD 1.07 Å
- 5FPR chain A against the predicted model Q9AIU7: TM-score 0.98, RMSD 1.07 Å
- 5FPR chain A against the predicted model Q9AIU7: TM-score 0.98, RMSD 1.07 Å
- 3JSL chain B against the predicted model Q9AIU7: TM-score 0.98, RMSD 1.08 Å
- 3JSL chain B against the predicted model Q9AIU7: TM-score 0.98, RMSD 1.08 Å
- 3JSL chain A against the predicted model Q9AIU7: TM-score 0.98, RMSD 1.08 Å
- 3JSL chain A against the predicted model Q9AIU7: TM-score 0.98, RMSD 1.08 Å
Elsewhere
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