Table I. Data collection statistics.
| Wavelength (Å) | Resolution (Å) (last shell) | No. of observed/unique reflections | Completeness (%) overall/last shell | I/σ(I) overall/last shell | Rsyma (%) overall/last shell |
|---|---|---|---|---|---|
| 0.7250 (λ1) | 20–2.3 (2.38–2.3) | 112 124/12 635 | 100/99.9 | 24.4/3.3 | 7.7/34.2 |
| 0.7255 (λ2) | 20–2.5 (2.59–2.5) | 84 790/9887 | 100/100 | 21.5/3.7 | 8.1/33.2 |
| 0.9773 (λ3) | 20–2.12 (2.2–2.12) | 138 893/15 941 | 100/99.8 | 28.2/3.1 | 6.8/37.3 |
| 0.9783 (λ4) | 20–2.3 (2.38–2.3) | 104 450/12 575 | 100/99.9 | 23.5/3.3 | 7.7/39.1 |
| 0.9840 (λ5) | 20–2.3 (2.38–2.3) | 106 354/12 369 | 100/99.9 | 24.2/4.2 | 6.2/33.1 |
| 0.9050 (λ6) | 20–2.3 (2.38–2.3) | 107 038/12 969 | 100/99.9 | 23.8/2.8 | 7.4/37.9 |
aRsym = (Σ|I – <I>|/ΣI), where I is the observed intensity and <I> is the average intensity of symmetry-related reflections.