Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL15A1 |
| Synchrotron site | NSRRC |
| Beamline | BL15A1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2019-03-21 |
| Detector | RAYONIX MX300-HS |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 65 |
| Unit cell lengths | 115.559, 115.559, 112.958 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 27.180 - 2.540 |
| R-factor | 0.1942 |
| Rwork | 0.192 |
| R-free | 0.23970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.037 |
| Data reduction software | HKL-2000 (2.3.10) |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP (11) |
| Refinement software | PHENIX ((1.21.1_5286: ???)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 30.000 | 30.000 | 2.630 |
| High resolution limit [Å] | 2.540 | 5.460 | 2.540 |
| Rmerge | 0.065 | 0.021 | 0.376 |
| Rmeas | 0.025 | 0.460 | |
| Rpim | 0.014 | 0.259 | |
| Number of reflections | 27738 | 2678 | 2823 |
| <I/σ(I)> | 12.8 | ||
| Completeness [%] | 98.0 | 92.6 | 99.8 |
| Redundancy | 2.9 | 3 | 2.9 |
| CC(1/2) | 0.999 | 0.825 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | isopropanol, Bis-Tris pH 7.1, PEG 400, PEG 1000 |
