6K62
Crystal structure of Xanthomonas PcrK
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-10-03 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.9785 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 105.137, 105.137, 103.671 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.880 - 2.550 |
| R-factor | 0.201 |
| Rwork | 0.198 |
| R-free | 0.25200 |
| Structure solution method | SAD |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.120 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.710 |
| High resolution limit [Å] | 2.550 | 2.550 |
| Rmerge | 0.836 | |
| Rmeas | 0.873 | |
| Number of reflections | 21899 | 3443 |
| <I/σ(I)> | 23.98 | 2.93 |
| Completeness [%] | 99.8 | 99.2 |
| Redundancy | 11 | 11.1 |
| CC(1/2) | 0.869 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.08 M MES monohydrate PH 6.5, 1.28 M Magnesium sulfate heptahydrate, 0.02 M Sodium cacodylate trihydrate pH 6.5, 0.28 M Sodium acetate trihydrate, 1.2% w/v myo-Inositol |
