3A5W
Peroxiredoxin (wild type) from Aeropyrum pernix K1 (reduced form)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | Bruker DIP-6040 |
| Wavelength(s) | 0.91498 |
| Spacegroup name | P 1 |
| Unit cell lengths | 77.609, 104.781, 106.169 |
| Unit cell angles | 105.91, 104.92, 92.88 |
Refinement procedure
| Resolution | 46.830 - 2.200 |
| R-factor | 0.21198 |
| Rwork | 0.209 |
| R-free | 0.26917 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.033 |
| RMSD bond angle | 2.443 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.280 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.095 | 0.426 |
| Number of reflections | 147958 | |
| <I/σ(I)> | 9.6 | 2.3 |
| Completeness [%] | 94.8 | 93.9 |
| Redundancy | 2.1 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1M imidazole-HCl, 1M sodium acetate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
