7AQ7
Pseudomonas stutzeri nitrous oxide reductase mutant, H583Y
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-11-24 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 1.369980 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 68.734, 76.071, 108.467 |
Unit cell angles | 90.00, 93.49, 90.00 |
Refinement procedure
Resolution | 68.606 - 1.608 |
R-factor | 0.1546 |
Rwork | 0.152 |
R-free | 0.20430 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6rkz |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 68.606 | 1.806 |
High resolution limit [Å] | 1.608 | 1.608 |
Number of reflections | 91516 | 4576 |
<I/σ(I)> | 16.6 | |
Completeness [%] | 94.6 | |
Redundancy | 6.6 | |
CC(1/2) | 0.999 | 0.714 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M bis-tris propane buffer at pH 8.5, 0.1 M sodium formate, 0.1 M sodium chloride, and 25% (w/v) of a medium molecular weight (MMW) polyethylene glycol mixture (PEG 2K, 3350, 4K and 5K MME) |