Table 2.
XPRT-ppGpp structure re-refinement statistics.
| Refinement | |
|---|---|
| Resolution range (highest resolution bin) (Å) | 34.23 – 1.8 (1.864 – 1.8) |
| Rwork/Rfreea (%) | 15.98 / 20.83 |
| r.m.s.b deviations | |
| Bonds (Å) | 0.0038 |
| Angles (Å) | 0.76 |
| Ramachandran statistics (%) | |
| Favored | 96.21 |
| Allowed | 3.66 |
| Disallowed | 0.13 |
| Rotamer outliers (%) | 0.00 |
| No. atoms | |
| Macromolecules | 11763 |
| Ligands | 188 |
| Solvent | 756 |
| B factor (Å2) | |
| Macromolecules | 25.98 |
| Ligands | 25.31 |
| Solvent | 33.25 |
a
Rwork/Rfree = Σ||Fobs|-|Fcalc||/|Fobs|, where the working the free R factors are calculated by using the working and free reflection sets, respectively. The free R reflections were held aside throughout refinement.
b
Root mean square