5XGB
Crystal structure of the PAS-GGDEF-EAL domain of PA0861 from Pseudomonas aeruginosa
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-06-15 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1.0000 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 134.720, 134.720, 210.450 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 70.150 - 2.280 |
| R-factor | 0.194 |
| Rwork | 0.193 |
| R-free | 0.22900 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.110 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP (BALBES, BUCANEER) |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.200 | 2.400 |
| High resolution limit [Å] | 2.280 | 2.280 |
| Rmerge | 0.124 | 1.060 |
| Rpim | 0.054 | 0.454 |
| Number of reflections | 33717 | 4851 |
| <I/σ(I)> | 10.7 | 1.7 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 6 | 6.1 |
| CC(1/2) | 0.997 | 0.517 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 0.1 M MES/imidazole at pH 6.5, 0.1 M carboxylic acid, 10% (w/v) PEG 4000 |
