2VJ5
Shigella flexneri MxiC
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 173 |
| Detector technology | CCD |
| Collection date | 2007-06-22 |
| Detector | ADSC CCD |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 91.370, 91.370, 215.840 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.600 - 3.000 |
| R-factor | 0.246 |
| Rwork | 0.246 |
| R-free | 0.27000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2vix |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.773 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | TNT (5.13.1.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.600 | 3.160 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.070 | 0.430 |
| Number of reflections | 18676 | |
| <I/σ(I)> | 14 | 4.5 |
| Completeness [%] | 98.5 | 98.4 |
| Redundancy | 6.9 | 7.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 0.2 M NA2SO4, 0.1 M BISTRISPROPANE PH 6.5, 20% PEG3350 |
