7AKH
Structure of DYRK2 in complex with compound 58
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2010-01-30 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 42 21 2 |
| Unit cell lengths | 84.240, 84.240, 150.060 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.850 |
| R-factor | 0.1879 |
| Rwork | 0.185 |
| R-free | 0.24480 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3k2l |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.591 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 84.200 | 2.880 |
| High resolution limit [Å] | 2.810 | 2.810 |
| Rmerge | 0.097 | 0.874 |
| Number of reflections | 13805 | 984 |
| <I/σ(I)> | 12.2 | 2.2 |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 6.9 | 7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 25% PEG 4k, 0.1M Tris buffer pH 8.5, 0.1M Li sulphate |
