8PX1
Structure of salmonella effector SseK3, solved at wavelength 2.75 A
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 | 2017-03-09 |
| Detector | DECTRIS PILATUS 12M |
| Wavelength(s) | 2.7552 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 96.080, 75.020, 101.890 |
| Unit cell angles | 90.00, 109.52, 90.00 |
Refinement procedure
| Resolution | 49.930 - 2.100 |
| R-factor | 0.25387 |
| Rwork | 0.252 |
| R-free | 0.29317 |
| Structure solution method | SAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.302 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | HKL2Map |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.930 | 2.175 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.166 | 1.796 |
| Rmeas | 0.169 | |
| Rpim | 0.035 | 0.381 |
| Number of reflections | 62053 | 4943 |
| <I/σ(I)> | 13.34 | 1.79 |
| Completeness [%] | 77.3 | |
| Redundancy | 23 | |
| CC(1/2) | 0.997 | 0.703 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M Tris pH 8.5, 0.2 M NaCl and 25% PEG3350 |
