3DAE
Crystal structure of phosphorylated SNF1 kinase domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BSRF BEAMLINE 3W1A |
Synchrotron site | BSRF |
Beamline | 3W1A |
Temperature [K] | 150 |
Detector technology | CCD |
Collection date | 2007-06-24 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.00001 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 74.607, 72.370, 112.920 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.192 - 2.899 |
R-factor | 0.229 |
Rwork | 0.227 |
R-free | 0.26500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2EUE |
RMSD bond length | 0.013 |
RMSD bond angle | 1.419 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.200 | 3.000 |
High resolution limit [Å] | 2.899 | 2.899 |
Rmerge | 0.087 | 0.382 |
Total number of observations | 102012 | |
Number of reflections | 14122 | |
<I/σ(I)> | 20.7 | 4.29 |
Completeness [%] | 100.0 | 100 |
Redundancy | 7.4 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | Tris pH 8.5, 3.2-3.6M NH4Ac, vapor diffusion, hanging drop, temperature 298K |