7AFW
Beta-Catenin in complex with compound 6
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | RIGAKU MICROMAX-003 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-11-27 |
Detector | RIGAKU |
Wavelength(s) | 1.541800 |
Spacegroup name | P 3 2 1 |
Unit cell lengths | 53.453, 53.453, 87.545 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 87.550 - 1.814 |
R-factor | 0.2299 |
Rwork | 0.227 |
R-free | 0.28130 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3sla |
RMSD bond length | 0.009 |
RMSD bond angle | 0.970 |
Data reduction software | autoPROC |
Data scaling software | autoPROC (1.1.7) |
Refinement software | BUSTER (2.11.7) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 87.545 | 1.929 |
High resolution limit [Å] | 1.814 | 1.814 |
Rmerge | 0.075 | 0.825 |
Number of reflections | 11045 | 1066 |
<I/σ(I)> | 24.6 | 1 |
Completeness [%] | 80.9 | 24.5 |
Redundancy | 8.3 | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 278 | 25% PEG 3350, 100 mM BIS-TRIS buffer pH 5.5 and 0.2 M Magnesium chloride |