7L1X
Structure of human CK2 alpha kinase (catalytic subunit) with the inhibitor 108600.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-D |
| Synchrotron site | APS |
| Beamline | 23-ID-D |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-06-21 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.98011 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 58.348, 45.981, 63.683 |
| Unit cell angles | 90.00, 111.84, 90.00 |
Refinement procedure
| Resolution | 24.880 - 1.800 |
| R-factor | 0.1754 |
| Rwork | 0.173 |
| R-free | 0.22120 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3owj |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.225 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 1.840 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.091 | 0.500 |
| Number of reflections | 28233 | 1485 |
| <I/σ(I)> | 18.51 | |
| Completeness [%] | 97.3 | |
| Redundancy | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 100 mM Tris-HCl pH 7.5 200 mM ammonium sulfate 21% PEG5000 |
