5EP1
Quorum-Sensing Signal Integrator LuxO - Catalytic Domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE F1 |
Synchrotron site | CHESS |
Beamline | F1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-10-23 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9782 |
Spacegroup name | P 61 |
Unit cell lengths | 76.307, 76.307, 82.387 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 24.977 - 1.500 |
R-factor | 0.1632 |
Rwork | 0.162 |
R-free | 0.18330 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.145 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | PHENIX (1.10-2155_1692) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 35.000 | 35.000 | 1.530 |
High resolution limit [Å] | 1.500 | 4.070 | 1.500 |
Rmerge | 0.057 | 0.046 | 0.336 |
Rmeas | 0.061 | 0.050 | 0.362 |
Rpim | 0.021 | 0.017 | 0.131 |
Total number of observations | 338644 | ||
Number of reflections | 43619 | ||
<I/σ(I)> | 8.6 | ||
Completeness [%] | 99.9 | 99.9 | 99.4 |
Redundancy | 7.8 | 7.9 | 7 |
CC(1/2) | 0.998 | 0.968 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 100 mM Tris buffer pH8.0, 4 M ammonium acetate |