2ZHH
Crystal structure of SoxR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-02-15 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0000 |
Spacegroup name | P 62 |
Unit cell lengths | 80.006, 80.006, 88.118 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 14.950 - 3.200 |
R-factor | 0.244 |
Rwork | 0.244 |
R-free | 0.27600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2zhg |
RMSD bond length | 0.009 |
RMSD bond angle | 1.500 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.310 |
High resolution limit [Å] | 3.200 | 3.200 |
Number of reflections | 4881 | |
<I/σ(I)> | 27.1 | 7.2 |
Completeness [%] | 90.8 | 58.8 |
Redundancy | 5.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.6 | 277 | 0.1M Tris-HCl pH 8.6, 2% (w/v) PEG 10000, 30% (v/v) glycerol, VAPOR DIFFUSION, SITTING DROP, temperature 277K |