3WNU
The crystal structure of catalase-peroxidase, KatG, from Synechococcus PCC7942
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL38B1 |
Synchrotron site | SPring-8 |
Beamline | BL38B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-05-26 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.0 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 108.744, 108.744, 202.888 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.390 - 2.200 |
R-factor | 0.16956 |
Rwork | 0.168 |
R-free | 0.20602 |
RMSD bond length | 0.020 |
RMSD bond angle | 2.038 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.950 | 2.270 |
High resolution limit [Å] | 2.190 | 2.190 |
Rmerge | 0.155 | |
Number of reflections | 63054 | |
<I/σ(I)> | 3.5 | |
Completeness [%] | 99.6 | 95.9 |
Redundancy | 6.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.3 | 277 | Sodium formate, pH 6.3, VAPOR DIFFUSION, HANGING DROP, temperature 277K |