Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2004-08-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92 |
| Spacegroup name | P 65 |
| Unit cell lengths | 75.715, 75.715, 122.855 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 44.830 - 1.900 |
| R-factor | 0.1681 |
| Rwork | 0.166 |
| R-free | 0.20840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.074 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.19.2_4158: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.830 | 1.940 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.088 | 0.725 |
| Number of reflections | 31384 | 2039 |
| <I/σ(I)> | 12 | 2.3 |
| Completeness [%] | 99.8 | |
| Redundancy | 5.9 | |
| CC(1/2) | 0.998 | 0.762 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 25% (w/v) PEG 6,000 100 mM LiCl 100 mM HEPES pH 75. |
