Table 1. Crystal and data-collection statistics.
Temperature (K) | 100 |
X-ray source | APS, BioCARS, 14-BM-C |
Detector | ADSC Quantum 315 |
Wavelength (Å) | 1.0000 |
Space group, crystal system | P41212, tetragonal |
Unit-cell parameters (Å) | a = b = 86.6, c = 104.3 |
Matthews coefficient VM (Å3 Da−1) | 2.7 |
Solvent content (%) | 53.5 |
Molecules per ASU | 1 |
Resolution range (Å) | 100–1.80 (1.86–1.80) |
Mosaicity (°) | 0.3 |
Total observations | 172279 |
Unique observations | 37229 |
Multiplicity | 4.6 (4.7) |
Data completeness (%) | 99.1 (100) |
〈I/σ(I)〉 | 43.8 (2.6) |
Rmerge† (%) | 3.0 (50.5) |
R merge = , where I i(hkl) is the ith observation of reflection hkl and 〈I(hkl)〉 is the weighted average intensity for all observations i of reflection hkl.