Table 1. Data collections and phasing statistics for SM-SPAP.
Diffraction data | peak | edge | remote | |
Unit Cell (Å) | a = 87.20 | b = 87.20 | c = 165.2 | |
Wavelength (Å) | 0.980159 | 0.980337 | 0.976261 | |
Resolution (Å) | 1.85 (1.9–1.85) | 1.85 (1.9–1.85) | 1.9 (2.0–1.9) | |
Space group | P41212 | P41212 | P41212 | |
No. of observed reflections | 771391 (56396) | 771426 (56386) | 713097 (92791) | |
No. of unique reflections | 103688 (7964) | 103898 (7994) | 95461 (13050) | |
Completeness | 100 (100) | 100 (100) | 99.3 (95.4) | |
Multiplicity | 7.44 (7.08) | 7.42 (7.05) | 7.47 (7.11) | |
R-sym1 (%) | 7.3 (49.8) | 7.0 (53.8) | 8.0 (56.7) | |
I/σ(I) | 20.2 (4.13) | 20.9 (3.82) | 20.3 (3.89) |
The numbers between parentheses indicate the value in the outer resolution shell.