4CEG
Crystal structure of Aurora A 122-403 C290A, C393A bound to ADP
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 | 2013-10-27 |
| Detector | DECTRIS PILATUS 2M |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 80.950, 80.950, 174.530 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 70.105 - 2.100 |
| R-factor | 0.2017 |
| Rwork | 0.200 |
| R-free | 0.23750 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ol7 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.223 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.100 | 2.150 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.050 | 0.670 |
| Number of reflections | 20591 | |
| <I/σ(I)> | 36.8 | 4.6 |
| Completeness [%] | 99.9 | 99.6 |
| Redundancy | 19.2 | 17.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 8.5 | PROTEIN WAS CRYSTALLISED IN 0.1 M TRIS-HCL PH 8.5, 0.2 M MGCL2, 0.5 M NACL, 32.5 % PEG 3350 AFTER INCUBATION WITH 5 MM ADP/MGCL2 BY VAPOUR DIFFUSION |
