6ISE
Crystal structure of AMPPNP bound CK2 alpha from C. neoformans
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 11C |
Synchrotron site | PAL/PLS |
Beamline | 11C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-04-12 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.97 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 89.877, 95.594, 93.300 |
Unit cell angles | 90.00, 90.04, 90.00 |
Refinement procedure
Resolution | 47.840 - 2.800 |
R-factor | 0.19808 |
Rwork | 0.196 |
R-free | 0.22974 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1lp4 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.556 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.850 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.075 | 0.161 |
Number of reflections | 18151 | |
<I/σ(I)> | 18.7 | |
Completeness [%] | 97.8 | |
Redundancy | 5.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 290 | 0.2 M lithium sulfate, 0.1 M Tris pH 8.5, 30 %(w/v) PEG 4000, 30%(w/v) dextran sulfate sodium salt, 2 mM MgCl2, 5 mM AMPPNP |