5LQ7
Salmonella effector SpvD - G161 variant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-05-12 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97949 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.000, 51.970, 47.220 |
Unit cell angles | 90.00, 107.70, 90.00 |
Refinement procedure
Resolution | 44.980 - 1.600 |
R-factor | 0.1649 |
Rwork | 0.163 |
R-free | 0.19730 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5lq6 |
RMSD bond length | 0.016 |
RMSD bond angle | 1.410 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHENIX |
Refinement software | REFMAC (5.8.0107) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 51.970 | 1.690 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.104 | |
Number of reflections | 26737 | |
<I/σ(I)> | 10.4 | 1.9 |
Completeness [%] | 99.4 | 99.2 |
Redundancy | 5.9 | 6 |
CC(1/2) | 0.579 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 277 | 100 mM Tris, 200 mM NaCl, 22 % PEG3350 |