5WA0
Crystal Structure of the sulfite dehydrogenase, SorT R78Q mutant from Sinorhizobium meliloti
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-01-01 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 95.520, 91.780, 109.670 |
| Unit cell angles | 90.00, 90.56, 90.00 |
Refinement procedure
| Resolution | 43.940 - 2.100 |
| R-factor | 0.2201 |
| Rwork | 0.217 |
| R-free | 0.27130 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4pw3 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.435 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 50.000 |
| High resolution limit [Å] | 2.100 |
| Number of reflections | 95573 |
| <I/σ(I)> | 6.3 |
| Completeness [%] | 86.1 |
| Redundancy | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6 | 273 | 0.1 M Bis-Tris propane pH 6.0, 0.2 M sodium malonate, 17.5% PEG3350 |
