4OER
Crystal structure of NikA from Brucella suis, unliganded form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Detector technology | PIXEL |
| Collection date | 2012-02-27 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97627 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 176.020, 62.231, 114.483 |
| Unit cell angles | 90.00, 105.30, 90.00 |
Refinement procedure
| Resolution | 43.666 - 1.850 |
| R-factor | 0.1867 |
| Rwork | 0.185 |
| R-free | 0.22170 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1zlq |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.106 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.670 | 1.950 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Number of reflections | 99676 | |
| <I/σ(I)> | 15.87 | 3.29 |
| Completeness [%] | 97.4 | 93.1 |
| Redundancy | 3.4 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 1.7 M ammonium sulfate, 0.1 M Tris pH 8.5, 25 mM MgSO4, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
