5ODT
Aurora-A in complex with TACC3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-02-13 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.92 |
Spacegroup name | I 2 3 |
Unit cell lengths | 137.040, 137.040, 137.040 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 68.520 - 2.021 |
R-factor | 0.1794 |
Rwork | 0.178 |
R-free | 0.21110 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ceg |
RMSD bond length | 0.008 |
RMSD bond angle | 1.047 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | PHENIX (1.8.4_1496) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 68.520 | 2.070 |
High resolution limit [Å] | 2.021 | 2.020 |
Rmerge | 0.087 | 0.193 |
Number of reflections | 28159 | |
<I/σ(I)> | 25.9 | 1.9 |
Completeness [%] | 100.0 | 100 |
Redundancy | 20 | 20.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 292 | 0.1 M Bis-Tris pH 5.5, 2 M Ammonium sulphate |