Table 1.
Hg inflection | Hg peak | Hg remote | Native | |
---|---|---|---|---|
Wavelength (Å) | 1.0092 | 1.0075 | 1.0015 | 0.8856 |
Unit cell (Å) | 109.2, 286.1, 91.5 | 109.2, 286.7, 91.5 | 108.9, 284.1, 91.2 | 107.7, 285.2, 91.8 |
Resolution range (Å) | 26–2.35 | 26–2.27 | 26–2.27 | 14.4–2.00 |
Number of unique reflections | 58,766 | 64,819 | 64,311 | 93,248 |
Completeness (%) 1 | 97.1 (98.3) | 96.1 (87.8) | 97.5 (99.1) | 98.4 (98.3) |
I/σ(I) 1 | 9.6 (2.6) | 9.52 (2.1) | 9.1 (2.3) | 7.4 (1.6) |
R sym(I) (%) 1 | 7.0 (24.7) | 7.2 (29.0) | 7.7 (29.4) | 8.4 (37.3) |
1Data for outer shell are in parentheses