Table 1. Data-collection and refinement statistics for RutC from E. coli .
Values in parentheses are for the highest resolution shell.
| Data collection | |
| Wavelength () | 0.9787 |
| Unit-cell parameters (, ) | a = 92.3, b = 179.2, c = 45.2, = = = 90.00 |
| Space group | P21212 |
| Resolution range () | 501.95 (1.981.95) |
| No. of observations | 534145 |
| No. of unique reflections | 55640 |
| Data completeness (%) | 99.9 (100) |
| R merge | 0.094 (0.633) |
| I/(I) | 34.3 (3.0) |
| Refinement | |
| No. of protein atoms | 5666 |
| Mean B value for protein atoms (2) | 43.3 |
| No. of water atoms | 342 |
| Mean B value for water atoms (2) | 45.0 |
| R work (%) | 19.5 |
| R free (%) | 21.7 |
| R.m.s.d. bond lengths () | 0.018 |
| R.m.s.d. bond angles () | 1.7 |
| Geometry | |
| Ramachandran outliers (%) | 0 |
| Ramachandran favored (%) | 98.8 |
| Residues with bad bonds (%) | 0 |
| Residues with bad angles (%) | 0.13 |
| Clashscore | 5.65 |
| Clashscore percentile | 96 |