Table 1.
Crystallographic data and refinement statistics for YngB (SeMet)
| Data collection | |
| Space group | I 21 21 21 |
| Cell dimensions | |
| a, b, c (Å) | 53.91 158.61 179.50 |
| α, β, γ (°) | 90.000 90.000 90.00 |
| Wavelength (Å) | 0.9794 |
| Resolution (Å) | 51.09–2.80 (2.95–2.80) |
| No. of reflections | 36,539 (5279) |
| Unique reflections | 19,457 (2777) |
| Rmerge | 0.067 (0.468) |
| Rmeas | 0.095 (0.661) |
| CC(1/2) | 0.994 (0.695) |
| I/σ(I) | 5.6 (1.2) |
| Completeness (%) | 99.8 (98.8) |
| Redundancy | 1.9 (1.9) |
| Wilson B-factor (Å2) | 79.0 |
| No. of protein molecules/asym. unit | 2 |
| Refinement | |
| Resolution (Å) | 51.09–2.80 |
| No. of reflections all/free | 19,535/937 |
| Rwork/Rfree | 0.191/0.244 |
| No. of atoms | A 2197; B 2181 Water 54 |
| B factors (Å2) | |
| Protein | A 81.9; B 89.4 |
| Water | 72.58 |
| Clashscore | 19 |
| RMSD | |
| Bond lengths (Å) | 0.0070 |
| Bond angles (°) | 1.792 |
| Ramachandran plot | |
| Favored (%) | 89 |
| Allowed (%) | 11 |
| Outliers (%) | 0 |
| PDB accession code | 7B1R |
Statistics in brackets refer to the highest resolution shell.