Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | LNLS BEAMLINE D03B-MX1 |
| Synchrotron site | LNLS |
| Beamline | D03B-MX1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-01-01 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.427 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 43.376, 57.176, 53.937 |
| Unit cell angles | 90.00, 111.94, 90.00 |
Refinement procedure
| Resolution | 14.400 - 1.450 |
| R-factor | 0.157 |
| Rwork | 0.153 |
| R-free | 0.17500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1xm8 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.930 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 14.400 | 19.060 | 1.530 |
| High resolution limit [Å] | 1.450 | 4.590 | 1.450 |
| Rmerge | 0.073 | 0.054 | 0.316 |
| Total number of observations | 7568 | 32871 | |
| Number of reflections | 43405 | ||
| <I/σ(I)> | 6.7 | 11 | 1.9 |
| Completeness [%] | 99.9 | 96.5 | 100 |
| Redundancy | 5.4 | 5.5 | 5.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | PEG 20000, pH 6.5, vapor diffusion, hanging drop, temperature 277K |
