8IZC
Human CK1 Delta Kinase structure bound to Inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-05-16 |
Detector | RAYONIX MX-300 |
Wavelength(s) | 0.9795 |
Spacegroup name | P 1 |
Unit cell lengths | 44.999, 48.950, 82.052 |
Unit cell angles | 95.75, 95.25, 106.12 |
Refinement procedure
Resolution | 14.620 - 1.450 |
R-factor | 0.192 |
Rwork | 0.191 |
R-free | 0.20700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | in-house structure |
RMSD bond length | 0.010 |
RMSD bond angle | 0.980 |
Data reduction software | XDS |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.5) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 14.620 |
High resolution limit [Å] | 1.450 | 1.450 |
Rmerge | 0.036 | 0.036 |
Number of reflections | 113119 | 112996 |
<I/σ(I)> | 23 | |
Completeness [%] | 96.1 | 96.1 |
Redundancy | 2.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2 M SODIUM SULPHATE, 0.100 M SODIUM CITRATE PH 5.5 , 18% PEG3350 |