Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-04-04 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 49.345, 56.101, 74.556 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.828 - 2.220 |
| R-factor | 0.213386887335 |
| Rwork | 0.212 |
| R-free | 0.23361 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4LEG |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.521 |
| Data reduction software | SAINT (1.0) |
| Data scaling software | SADABS |
| Phasing software | PHASER (2.1) |
| Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.360 | 2.300 |
| High resolution limit [Å] | 2.220 | 2.220 |
| Rmerge | 0.049 | 0.102 |
| Number of reflections | 17003 | |
| <I/σ(I)> | 13.3 | |
| Completeness [%] | 86.0 | 90.7 |
| Redundancy | 1.8 | 1.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | 0.2 M ammonium sulfate, 30% PEG 8000, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
