2.700 Å
X-ray
1999-04-30
| Name: | DNA-directed DNA polymerase |
|---|---|
| ID: | DPOL_BPR69 |
| AC: | Q38087 |
| Organism: | Enterobacteria phage RB69 |
| Reign: | Viruses |
| TaxID: | 12353 |
| EC Number: | / |
| Chain Name: | Percentage of Residues within binding site |
|---|---|
| A | 100 % |
| B-Factor: | 42.468 |
|---|---|
| Number of residues: | 29 |
| Including | |
| Standard Amino Acids: | 29 |
| Non Standard Amino Acids: | 0 |
| Water Molecules: | 0 |
| Cofactors: | |
| Metals: | |
| Ligandability | Volume (Å3) |
|---|---|
| 0.088 | 330.750 |
| % Hydrophobic | % Polar |
|---|---|
| 44.90 | 55.10 |
| According to VolSite | |

| HET Code: | GDP |
|---|---|
| Formula: | C10H12N5O11P2 |
| Molecular weight: | 440.177 g/mol |
| DrugBank ID: | DB04315 |
| Buried Surface Area: | 59.72 % |
| Polar Surface area: | 276.39 Å2 |
| Number of | |
|---|---|
| H-Bond Acceptors: | 14 |
| H-Bond Donors: | 4 |
| Rings: | 3 |
| Aromatic rings: | 1 |
| Anionic atoms: | 3 |
| Cationic atoms: | 0 |
| Rule of Five Violation: | 1 |
| Rotatable Bonds: | 6 |
| X | Y | Z |
|---|---|---|
| 54.2417 | -11.7387 | 34.6964 |
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 |
| O2' | OH | TYR- 33 | 3.32 | 137.27 | H-Bond (Ligand Donor) |
| O3' | OG | SER- 36 | 3.05 | 148.75 | H-Bond (Protein Donor) |
| C1' | CB | SER- 36 | 3.77 | 0 | Hydrophobic |
| C4' | CB | SER- 36 | 4.19 | 0 | Hydrophobic |
| C1' | CE1 | PHE- 38 | 4.14 | 0 | Hydrophobic |
| O3B | NZ | LYS- 48 | 3.72 | 0 | Ionic (Protein Cationic) |
| O3A | OH | TYR- 49 | 2.89 | 138.14 | H-Bond (Protein Donor) |
| O5' | OH | TYR- 49 | 3.43 | 139.41 | H-Bond (Protein Donor) |
| N7 | N | MET- 85 | 2.71 | 159.93 | H-Bond (Protein Donor) |
| N1 | O | LYS- 378 | 2.76 | 142.23 | H-Bond (Ligand Donor) |
| N2 | O | LYS- 378 | 2.67 | 156.47 | H-Bond (Ligand Donor) |
| O6 | N | ILE- 380 | 2.8 | 149.11 | H-Bond (Protein Donor) |