4YEG
Characterisation of Polyphosphate Kinase 2 from the Intracellular Pathogen Francisella tularensis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 273.15 |
Detector technology | PIXEL |
Collection date | 2013-02-07 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 86.790, 88.890, 163.300 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 76.638 - 2.230 |
R-factor | 0.2051 |
Rwork | 0.203 |
R-free | 0.24560 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3czq |
RMSD bond length | 0.014 |
RMSD bond angle | 1.464 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | BALBES |
Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 81.650 | 2.290 |
High resolution limit [Å] | 2.230 | 2.230 |
Rmerge | 0.052 | 0.539 |
Number of reflections | 61793 | |
<I/σ(I)> | 15.5 | |
Completeness [%] | 99.2 | 99.7 |
Redundancy | 3.6 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 294.15 | 0.8 M Na Citrate, 0.1 M Na HEPES, 2.5 mM AMP-PNP, 1 mM MgCl2 |