3EJF
Crystal structure of IBV X-domain at pH 8.5
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X13 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X13 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-06-08 |
Detector | MARRESEARCH |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 42.207, 79.811, 99.741 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 24.820 - 1.600 |
R-factor | 0.171 |
Rwork | 0.169 |
R-free | 0.20300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.349 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.3.0037) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.820 | 1.640 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.103 | 0.244 |
Number of reflections | 22201 | |
<I/σ(I)> | 18.371 | |
Completeness [%] | 97.9 | 97.1 |
Redundancy | 7.1 | 6.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.5 | 285.15 | 30% PEG 4000, 0.1 M TRIS PH 8.5, 0.2 M MAGENSIUM CHLORIDE, temperature 285.15K |