Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 5.2R |
| Synchrotron site | ELETTRA |
| Beamline | 5.2R |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2013-12-16 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.9686 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 63.317, 63.317, 262.604 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.575 - 2.896 |
| R-factor | 0.265 |
| Rwork | 0.261 |
| R-free | 0.30130 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.469 |
| Data reduction software | XDS (data procesiing) |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.580 | 3.070 |
| High resolution limit [Å] | 2.896 | 2.900 |
| Rmerge | 0.192 | 2.141 |
| Rmeas | 0.201 | 2.226 |
| Rpim | 0.054 | 0.814 |
| Number of reflections | 12678 | 1941 |
| <I/σ(I)> | 11.6 | 1.3 |
| Completeness [%] | 99.5 | 98.5 |
| Redundancy | 13.3 | 13.3 |
| CC(1/2) | 0.999 | 0.585 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | 0.1M CH3COONa , (0.2-0.4) M NH4(SO4)2, 25% w/VPEG 4000 |
