Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE TPS 05A |
| Synchrotron site | NSRRC |
| Beamline | TPS 05A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-12-05 |
| Detector | DECTRIS EIGER2 X 9M |
| Wavelength(s) | 0.99984 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 65.296, 200.343, 239.744 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 26.210 - 2.280 |
| R-factor | 0.2399 |
| Rwork | 0.237 |
| R-free | 0.29930 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.048 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.21.1_5286_000) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 30.000 | 30.000 | 2.360 |
| High resolution limit [Å] | 2.280 | 4.910 | 2.280 |
| Rmerge | 0.085 | 0.030 | 0.584 |
| Rmeas | 0.035 | 0.703 | |
| Rpim | 0.018 | 0.385 | |
| Number of reflections | 72243 | 7249 | 7153 |
| <I/σ(I)> | 9.9 | ||
| Completeness [%] | 99.4 | 95.4 | 99.6 |
| Redundancy | 3.7 | 3.7 | 3.1 |
| CC(1/2) | 0.999 | 0.577 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | NPS, Morpheus Buffer System 2, Morpheus Precipitant Mix 4 |
