2.750 Å
X-ray
2013-02-21
| Name: | Stimulator of interferon genes protein |
|---|---|
| ID: | STING_MOUSE |
| AC: | Q3TBT3 |
| Organism: | Mus musculus |
| Reign: | Eukaryota |
| TaxID: | 10090 |
| EC Number: | / |
| Chain Name: | Percentage of Residues within binding site |
|---|---|
| A | 60 % |
| B | 40 % |
| B-Factor: | 45.471 |
|---|---|
| Number of residues: | 31 |
| Including | |
| Standard Amino Acids: | 30 |
| Non Standard Amino Acids: | 1 |
| Water Molecules: | 0 |
| Cofactors: | |
| Metals: | |
| Ligandability | Volume (Å3) |
|---|---|
| 0.892 | 536.625 |
| % Hydrophobic | % Polar |
|---|---|
| 47.80 | 52.20 |
| According to VolSite | |

| HET Code: | 1K5 |
|---|---|
| Formula: | C15H10NO3 |
| Molecular weight: | 252.245 g/mol |
| DrugBank ID: | - |
| Buried Surface Area: | 69.73 % |
| Polar Surface area: | 60.44 Å2 |
| Number of | |
|---|---|
| H-Bond Acceptors: | 4 |
| H-Bond Donors: | 0 |
| Rings: | 3 |
| Aromatic rings: | 2 |
| Anionic atoms: | 1 |
| Cationic atoms: | 0 |
| Rule of Five Violation: | 0 |
| Rotatable Bonds: | 2 |
| X | Y | Z |
|---|---|---|
| -38.6239 | -0.705474 | 16.8932 |
Image generated by PoseView
Represent the protein/ligand binding mode, centered on the ligand
Dashed lines represents hydrogen bonds and metal interactions
Green residue labels for amino acids with hydrophobic contacts (green lines) to the ligand
| Ligand | Protein | Interaction | |||
|---|---|---|---|---|---|
| Atom | Atom | Residue | Distance (Å) | Angle (°) | Type |
| C13 | CB | SER- 161 | 4.08 | 0 | Hydrophobic |
| C12 | CB | SER- 161 | 3.58 | 0 | Hydrophobic |
| C13 | CB | TYR- 162 | 4.08 | 0 | Hydrophobic |
| C03 | CG2 | ILE- 164 | 3.84 | 0 | Hydrophobic |
| C01 | CD1 | ILE- 234 | 3.25 | 0 | Hydrophobic |
| O18 | NH1 | ARG- 237 | 2.58 | 146.75 | H-Bond (Protein Donor) |
| O18 | CZ | ARG- 237 | 3.52 | 0 | Ionic (Protein Cationic) |
| C06 | CB | THR- 262 | 3.62 | 0 | Hydrophobic |
| C12 | CG | PRO- 263 | 3.66 | 0 | Hydrophobic |
| C03 | CB | GLN- 265 | 3.88 | 0 | Hydrophobic |
| C04 | CB | THR- 266 | 4.37 | 0 | Hydrophobic |
| O15 | OG1 | THR- 266 | 2.64 | 168.24 | H-Bond (Protein Donor) |