Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2013-09-30 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 0.95372 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 48.900, 75.640, 335.090 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.070 - 2.950 |
| R-factor | 0.26559 |
| Rwork | 0.265 |
| R-free | 0.28153 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1XQU |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.485 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.070 | 3.100 |
| High resolution limit [Å] | 2.950 | 2.950 |
| Rmerge | 0.826 | |
| Number of reflections | 25808 | |
| <I/σ(I)> | 7.8 | 2.2 |
| Completeness [%] | 96.1 | 96.6 |
| Redundancy | 6.1 | 6.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 12.5% PEG 3350, 12.5% PEG 1000, 12.5% MPD, 0.03M AMINO ACID |
