7U31
Crystal structure of human GSK3B in complex with G5
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ELETTRA BEAMLINE 5.2R |
Synchrotron site | ELETTRA |
Beamline | 5.2R |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-03-09 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 82.650, 85.360, 178.360 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.830 - 2.380 |
R-factor | 0.2439 |
Rwork | 0.242 |
R-free | 0.27590 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1i09 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.388 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.830 | 2.480 |
High resolution limit [Å] | 2.380 | 2.380 |
Number of reflections | 51397 | 4613 |
<I/σ(I)> | 11.9 | |
Completeness [%] | 100.0 | |
Redundancy | 13.6 | |
CC(1/2) | 0.998 | 0.460 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 293 | PEG3350, Sodium Chloride, Hepes |