Table 1. Data-collection statistics.
Values in parentheses are for the outer resolution shell.
| X-ray source† | BESSY II | IP | IP | IP | IP |
| Wavelength () | 0.918 | 1.542 | 1.542 | 1.542 | 1.542 |
| Resolution () | 50.02.3 (2.422.30) | 40.82.6 (2.672.60) | 30.03.0 (3.163.00) | 40.53.1 (3.273.10) | 40.03.5 (3.623.50) |
| Space group | I41 | I41 | I41 | I41 | I41 |
| Unit-cell parameters () | |||||
| a = b | 64.7 | 64.3 | 64.0 | 64.4 | 64.1 |
| c | 156.1 | 158.1 | 157.0 | 156.1 | 157.5 |
| No. of observations | 107152 (15469) | 37107 (2658) | 20972 (2880) | 14941 (2168) | 12419 (1223) |
| No. of unique reflections | 14248 (2064) | 9801 (719) | 6301 (908) | 5417 (804) | 3933 (387) |
| Completeness (%) | 100.0 (100.0) | 99.4 (98.8) | 99.5 (99.6) | 99.5 (95.0) | 97.8 (99.2) |
| Multiplicity | 7.5 (7.5) | 3.8 (3.7) | 3.3 (3.2) | 2.8 (2.7) | 3.2 (3.2) |
| I/(I) | 16.0 (3.4) | 9.4 (2.5) | 10.0 (2.5) | 7.6 (2.4) | 9.2 (3.3) |
| Wilson B factor (2) | 49 | 76 | 71 | 80 | 46 |
| R merge | 0.072 (0.546) | 0.049 (0.696) | 0.107 (0.460) | 0.100 (0.406) | 0.120 (0.321) |
| twin | 0.14 | 0.09 | 0.26 | 0.19 | 0.21 |
†
BESSY II, beamline 14.1 at the BESSY II synchrotron-radiation source, Helmholtz-Zentrum Berlin; IP, Agilent Technologies Gemini Enhanced Ultra sealed tube at Institute of Physics AS CR, v.v.i., Prague.