Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-08-19 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 1 |
| Unit cell lengths | 46.440, 62.560, 107.979 |
| Unit cell angles | 91.76, 98.05, 111.83 |
Refinement procedure
| Resolution | 53.240 - 2.300 |
| R-factor | 0.1705 |
| Rwork | 0.168 |
| R-free | 0.22890 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2iip |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA (3.3.22) |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 106.481 | 53.240 | 2.420 |
| High resolution limit [Å] | 2.300 | 7.270 | 2.300 |
| Rmerge | 0.069 | 0.583 | |
| Rmeas | 0.167 | 0.082 | 0.689 |
| Rpim | 0.088 | 0.044 | 0.365 |
| Total number of observations | 147482 | ||
| Number of reflections | 44070 | 1493 | 6614 |
| <I/σ(I)> | 7.9 | 6.8 | 0.9 |
| Completeness [%] | 89.1 | 95.4 | 91.6 |
| Redundancy | 3.3 | 3.4 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 290.15 | 1.5 ammonium sulfate, 0.1 M HEPES pH 7.2 |
