Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX II BEAMLINE I911-5 |
| Synchrotron site | MAX II |
| Beamline | I911-5 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-05-29 |
| Detector | MARRESEARCH SX-165 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 174.840, 85.610, 61.120 |
| Unit cell angles | 90.00, 96.83, 90.00 |
Refinement procedure
| Resolution | 33.468 - 2.490 |
| R-factor | 0.1752 |
| Rwork | 0.175 |
| R-free | 0.22600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2X4B |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.647 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.900 | 2.610 |
| High resolution limit [Å] | 2.480 | 2.480 |
| Rmerge | 0.090 | 0.430 |
| Number of reflections | 30821 | |
| <I/σ(I)> | 13.1 | 2.3 |
| Completeness [%] | 98.1 | 87.7 |
| Redundancy | 3.7 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.6 | 30% (W/V) PEG 3350, 0.3 M NAI, pH 6.6 |
