5UQ1
Crystal structure of human Cdk2-Spy1 complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 273 |
Detector technology | CCD |
Collection date | 2016-03-03 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.000 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 75.359, 75.359, 325.791 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.111 - 3.201 |
R-factor | 0.2079 |
Rwork | 0.205 |
R-free | 0.26110 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.049 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.111 | 3.420 |
High resolution limit [Å] | 3.200 | 3.200 |
Rmerge | 0.170 | 0.800 |
Number of reflections | 17634 | 8971 |
<I/σ(I)> | 7.9 | 2.3 |
Completeness [%] | 94.7 | 81.3 |
Redundancy | 6.2 | 3.4 |
CC(1/2) | 0.980 | 0.620 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.2 | 295 | 1M lithium chloride, 12% PEG 6000, and 0.1M MES pH 6.2, harvested and flash frozen in the same solution with 20% PEG 200. |