7U2Z
Crystal structure of human GSK3B in complex with G12
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 | 82.250, 85.500, 178.150 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 89.070 - 2.210 |
R-factor | 0.2481 |
Rwork | 0.247 |
R-free | 0.26620 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1i09 |
RMSD bond length | 0.004 |
RMSD bond angle | 1.065 |
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] | 89.080 | 2.260 |
High resolution limit [Å] | 2.210 | 2.210 |
Number of reflections | 60774 | 4107 |
<I/σ(I)> | 6.9 | |
Completeness [%] | 95.6 | 87.8 |
Redundancy | 12.2 | 11.4 |
CC(1/2) | 0.993 | 0.360 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 293 | PEG3350, Sodium Chloride, Hepes |