TABLE 2.
Data collection, processing, and refinement statistics
| Parameter | Valueb for BlaC |
|---|---|
| Data collection | |
| Maximum resolution (Å) | 1.72 |
| Space group | P212121 |
| a (Å) | 42.7 |
| b (Å) | 71.3 |
| c (Å) | 85.2 |
| Unique reflections | 25,908 (2,808) |
| Rsyma (%) | 11.4 (30.6) |
| Completeness (%) | 91.1 (100) |
| Redundancy | 6.8 (6.9) |
| I/σ | 23.2 (6.8) |
| Refinement statistics | |
| Resolution range (Å) | 54.64-1.72 |
| Number of reflections | 24,570 |
| Number of atoms/subunit | |
| Protein | 2,230 |
| Solvent | 248 |
| Rcryst (%) | 17.9 |
| Rfree (%) | 21.4 |
| Avg B factors (Å2) | |
| Protein | 20.7 |
| Solvent | 32.8 |
| RMSD from ideal values | |
| Bonds (Å) | 0.011 |
| Angles (°) | 1.44 |
a
Rsym = ∑hkl∑iIi(hkl)−〈I(hkl)〉/∑hkl∑iIi(hkl), where Ii is the intensity of observation and 〈I〉 is the mean intensity of reflection.
b
The numbers given in parentheses denote the respective values of the highest-resolution shell.