Table 1.
Data collection and refinement statistics
| Data set | ND-GluRS |
|---|---|
| Data collection statistics | |
| Beamline | SPring-8BL41XU |
| Wavelength (Å) | 1.0000 |
| Space group | P212121 |
| Cell dimensions | |
| a, b, c (Å) | 54.07, 99.90, 105.4 |
| Resolution (Å) | 50.0–1.65 (1.71–1.65) |
| Unique reflections | 67 808 (5552) |
| Redundancy | 10.5 (3.7) |
| Completeness (%) | 97.6 (81.3) |
| I/s(I) | 42.9 (2.5) |
| Rsym | 0.063 (0.312) |
| Refinement statistics | |
| Resolution (Å) | 50.0–1.65 |
| Rwork (%) | 19.3 |
| Rfree (%) | 21.7 |
| σA coordinate error (Å) | 0.19 |
| No. of | |
| Protein atoms | 3,751 |
| Ligands/ions | 10 |
| Waters | 445 |
| Average B-factor (Å2) | |
| Protein | 27.8 |
| Ligand/ion | 28.8 |
| Water | 39.2 |
| RMSD from ideal values | |
| Bond lengths (Å) | 0.006 |
| Bond angles (°) | 1.041 |
| Ramachandran plot (%) | |
| Preferred | 91.4 |
| Allowed | 8.6 |
| Outliers | 0 |
Rwork = Σ|Fo – Fc|/ΣFo for reflections of work set.
Rfree = Σ|Fo – Fc|/ΣFo for reflections of test set.