Table 2. Data collection and processing.
Values in parentheses are for the outer shell.
| Diffraction source | BL17U1, SSRF |
| Wavelength (Å) | 0.97946 |
| Temperature (K) | 100 |
| Detector | ADSC Q315R |
| Rotation range per image (°) | 1 |
| Total rotation range (°) | 180 |
| Exposure time per image (s) | 0.8 |
| Space group | P21 |
| a, b, c (Å) | 33.1, 61.6, 48.4 |
| α, β, γ (°) | 90.00, 90.23, 90.00 |
| Resolution range (Å) | 38.07–1.40 (1.44–1.40) |
| Total No. of reflections | 130565 |
| No. of unique reflections | 34978 |
| Completeness (%) | 91.7 (56.0) |
| 〈I/σ(I)〉 | 12.3 (3.0) |
| R merge (%)† | 5.0 (34.7) |
| Multiplicity | 3.7 (3.4) |
| CC1/2 | 0.997 (0.803) |
†
R
merge = 
, where I
i(hkl) are the intensities of the individual measurements of a given reflection hkl and 〈I(hkl)〉 is the average intensity over all replicates of that reflection, 
is the sum over all reflections and 
is the sum over i measurements of the reflection.