Table 1. Statistics of the peak-wavelength single-wavelength anomalous dispersion data set.
Data set | Peak |
---|---|
Wavelength, Å | 0.97930 |
Resolution, Å | 50.0 to 2.80 |
Redundancy | 8.4 (8.7)* |
Unique reflections | 29,551 (1,478) |
Completeness, % | 100 (100) |
I/σ | 13.7 (2.6) |
Rsym,† % | 11.2 (81.2) |
Numbers in parentheses refer to the highest-resolution shell, which is 2.85 to 2.80 Å for all the peak-wavelength data set.
Rsym = Σhkl Σi| Ihkl, i - 〈I〉hkl|/Σ|Ihkl|.