9SQ7
Crystal structure of Aurora-A bound to DBS2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 199 |
| Detector technology | PIXEL |
| Collection date | 2024-08-05 |
| Detector | DECTRIS EIGER2 X 16M |
| Wavelength(s) | 0.9762 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 84.049, 84.049, 201.105 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 58.961 - 2.899 |
| Rwork | 0.204 |
| R-free | 0.24390 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.980 |
| Data reduction software | xia2 |
| Data scaling software | DIALS |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 58.961 | 2.950 |
| High resolution limit [Å] | 2.899 | 2.900 |
| Number of reflections | 18955 | 883 |
| <I/σ(I)> | 29.6 | |
| Completeness [%] | 99.9 | |
| Redundancy | 16.6 | |
| CC(1/2) | 1.000 | 1.000 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.12 M Alcohols, 0. 1M Buffer system 3 pH 8.5, 30 % Precipitant mix 1 |
