7AQ3
Pseudomonas stutzeri nitrous oxide reductase mutant, H583D
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) | 1.370000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 69.664, 76.608, 109.087 |
Unit cell angles | 90.00, 93.26, 90.00 |
Refinement procedure
Resolution | 47.330 - 1.639 |
R-factor | 0.1579 |
Rwork | 0.156 |
R-free | 0.19890 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6rkz |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 62.659 | 1.783 |
High resolution limit [Å] | 1.639 | 1.642 |
Number of reflections | 110028 | 5502 |
<I/σ(I)> | 16.2 | |
Completeness [%] | 95.2 | |
Redundancy | 6.6 | |
CC(1/2) | 0.999 | 0.636 |
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) |