8QEG
Crystal structure of the G11 protein heterotrimer bound to YM-254890 inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-05-23 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 72.604, 102.533, 154.002 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 59.253 - 1.700 |
Rwork | 0.160 |
R-free | 0.18810 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.598 |
Data reduction software | XDS |
Data scaling software | autoPROC |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0403) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 85.350 | 1.730 |
High resolution limit [Å] | 1.700 | 1.700 |
Number of reflections | 126840 | 6244 |
<I/σ(I)> | 22.4 | 1.9 |
Completeness [%] | 100.0 | 100 |
Redundancy | 13.7 | 14.2 |
CC(1/2) | 1.000 | 0.796 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 277 | 0.09 M Na Acetate pH 4.5, 2.7 % PEG Smears Medium, 6.3 % MPD, 0.5 n-octyl-beta-D-Glucoside and 3% D-Trehalose |