6KRM
Peroxiredoxin from Aeropyrum pernix K1 (ApPrx) 0Cys F46A mutant
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 | PIXEL |
Collection date | 2019-05-16 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9 |
Spacegroup name | P 1 |
Unit cell lengths | 75.996, 103.077, 104.801 |
Unit cell angles | 105.80, 105.25, 92.53 |
Refinement procedure
Resolution | 49.252 - 1.800 |
Rwork | 0.163 |
R-free | 0.19810 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2e2g |
RMSD bond length | 0.012 |
RMSD bond angle | 1.762 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0257) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.830 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.057 | 0.470 |
Number of reflections | 263527 | 12878 |
<I/σ(I)> | 9.6 | 2.3 |
Completeness [%] | 97.0 | |
Redundancy | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M Sodium citrate tribasic dihydrate pH 5.6, 1.0 M Ammonium phosphate monobasic |