Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE MASSIF-1 |
| Synchrotron site | ESRF |
| Beamline | MASSIF-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-02-25 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.965 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 34.076, 34.076, 113.672 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 18.945 - 1.700 |
| R-factor | 0.2031 |
| Rwork | 0.202 |
| R-free | 0.22300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3k82 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.32) |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 18.950 | 18.950 | 1.730 |
| High resolution limit [Å] | 1.700 | 9.000 | 1.700 |
| Rmerge | 0.056 | 0.052 | 0.334 |
| Rmeas | 0.058 | 0.054 | 0.404 |
| Rpim | 0.014 | 0.014 | 0.222 |
| Number of reflections | 16133 | 81 | 454 |
| <I/σ(I)> | 22.5 | ||
| Completeness [%] | 99.7 | 91.2 | 99.9 |
| Redundancy | 8.8 | 14.2 | 3.2 |
| CC(1/2) | 0.999 | 0.999 | 0.918 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.2 M ammonium sulphate, 30% PEG 4000 |
