Table 1. Experimental conditions and data-collection statistics.
Data collection | Native | Zn peak | Edge | Remote |
---|---|---|---|---|
X-ray source | BL26B1, SPring-8 | BL26B1, SPring-8 | ||
Wavelength (Å) | 1.0000 | 1.28230 | 1.28275 | 1.3330 |
Detector | Jupiter 210cs CCD | Jupiter 210cs CCD | ||
Temperature (K) | 100 | 100 | ||
Crystal-to-detector distance (mm) | 180 | 150 | ||
Space group | P4 | P4 | ||
Unit-cell parameters (Å) | a = b = 100.944, c = 45.870 | a = b = 100.860, c = 45.959 | ||
Resolution range (Å) | 30.0–1.90 (1.97–1.90) | 50–2.30 (2.38–2.30) | ||
Total reflections | 245580 | 105929 | 100444 | 102657 |
Unique reflections | 36580 | 20641 | 20603 | 20593 |
Completeness (%) | 99.3 (99.2) | 98.8 (99.2) | 98.8 (99.3) | 98.7 (99.4) |
Rsym† | 6.6 (24.6) | 10.8 (26.0) | 10.6 (25.3) | 11.6 (28.5) |
Average 〈I/σ(I)〉 | 18.4 (3.8) | 17.9 (5.8) | 17.1 (5.2) | 16.8 (5.0) |
Redundancy | 6.7 | 5.1 | 4.9 | 5.0 |
Anomalous signal (asn‡) | 1.69 | |||
VM (Å3 Da−1) | 2.7 | |||
Z | 2 | |||
Solvent content (%) | 54.2 |
R sym = .
Average anomalous signal-to-noise ratio.