8QUR
Crystal structure of Ompk36 GD at 3500 eV with no absorption corrections
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I23 |
Synchrotron site | Diamond |
Beamline | I23 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2021-05-20 |
Detector | DECTRIS PILATUS 12M |
Wavelength(s) | 3.5424 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 232.078, 74.700, 91.350 |
Unit cell angles | 90.00, 112.21, 90.00 |
Refinement procedure
Resolution | 107.400 - 2.340 |
Rwork | 0.223 |
R-free | 0.26350 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.398 |
Data reduction software | DIALS |
Data scaling software | DIALS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0415) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 107.400 | 2.420 |
High resolution limit [Å] | 2.340 | 2.340 |
Number of reflections | 60652 | 5606 |
<I/σ(I)> | 11.99 | |
Completeness [%] | 98.8 | |
Redundancy | 10.8 | |
CC(1/2) | 0.996 | 0.814 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 293 | 0.1M Lithium sulfate, 0.1M sodium citrate pH 5.6 and 12% PEG4000 |