TABLE 1.
Data reduction and phasing statistics
| Parameter | Result fora:
|
||
|---|---|---|---|
| λ1 (remote) | λ2 (inflection) | λ3 (peak) | |
| Resolution (Å) | 50-2.89 (3.0-2.89) | 50-2.89 (3.0-2.89) | 50-2.89 (3.0-2.89) |
| Wavelength | 0.94645 | 0.97969 | 0.97955 |
| Completeness (%) | 92.7 (53.9) | 88.3 (33.0) | 93.2 (56.7) |
| Average redundancy | 3.8 (2.1) | 3.8 (1.6) | 2.1 (1.4) |
| No. of unique reflections | 71,733 | 68,606 | 72,213 |
| Rmerge | 0.084 (0.334) | 0.095 (0.395) | 0.098 (0.325) |
| I/σ(I) | 12.4 (1.4) | 10.7 (1.1) | 13.4 (1.5) |
| Phasing power | |||
| Anomalous | 0.72 | 1.33 | |
| Isomorphous | 1.34 | 0.66 | |
| Cullis R | |||
| Anomalous | 0.90 | 0.75 | |
| Isomorphous | 0.48 | 0.51 | |
a
Numbers in parentheses refer to the highest-resolution shell.