7U36
Crystal structure of human GSK3B in complex with ARN1484
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 | 82.201, 85.315, 178.358 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 77.080 - 2.750 |
R-factor | 0.2398 |
Rwork | 0.238 |
R-free | 0.27530 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1i09 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.358 |
Data reduction software | autoPROC |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 77.100 | 2.880 |
High resolution limit [Å] | 2.750 | 2.750 |
Number of reflections | 33334 | 4356 |
<I/σ(I)> | 7.8 | |
Completeness [%] | 100.0 | |
Redundancy | 13 | |
CC(1/2) | 0.994 | 0.498 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 293 | PEG3350, Sodium Chloride, Hepes |