6SFR
SOS1 in Complex with Inhibitor BI-68BS
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | RIGAKU MICROMAX-003 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-03-11 |
Detector | RIGAKU |
Wavelength(s) | 1.541800 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 84.000, 39.292, 176.494 |
Unit cell angles | 90.00, 90.03, 90.00 |
Refinement procedure
Resolution | 84.000 - 1.917 |
R-factor | 0.2 |
Rwork | 0.198 |
R-free | 0.24500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | inhouse |
Data reduction software | XDS (Jan 26, 201) |
Data scaling software | autoPROC (1.1.7) |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.7) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 84.000 | 2.028 |
High resolution limit [Å] | 1.917 | 1.917 |
Rmerge | 0.052 | 0.433 |
Number of reflections | 74854 | 3744 |
<I/σ(I)> | 14 | 1.5 |
Completeness [%] | 83.4 | 27.4 |
Redundancy | 2.8 | 1.5 |
CC(1/2) | 0.998 | 0.653 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.4 | 277 | 0.1 M Imidazole, 3% PEG8000 |