3NGA
Human CK2 catalytic domain in complex with CX-4945
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-BM |
Synchrotron site | APS |
Beamline | 17-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-10-19 |
Detector | MARRESEARCH |
Wavelength(s) | 0.9999 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 127.640, 127.640, 125.750 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 33.670 - 2.710 |
R-factor | 0.189 |
Rwork | 0.188 |
R-free | 0.21760 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.040 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | BUSTER (2.9.4) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 36.000 |
High resolution limit [Å] | 2.710 |
Number of reflections | 28836 |
<I/σ(I)> | 34 |
Completeness [%] | 100.0 |
Redundancy | 15 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 20-26% PEG 4000, 0.2 M ammonium sulfate, 0.1 M sodium citrate pH 6, 1 mM MgCl2 and 10 mM AMPPNP, VAPOR DIFFUSION, HANGING DROP, temperature 293K |