7X6G
Outer membrane lipoprotein QseG of Escherichia coli O157:H7
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-12-01 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.900 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 43.383, 149.928, 88.138 |
Unit cell angles | 90.00, 95.63, 90.00 |
Refinement procedure
Resolution | 37.854 - 2.350 |
Rwork | 0.245 |
R-free | 0.29640 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | AlphaFold structure |
RMSD bond length | 0.002 |
RMSD bond angle | 0.682 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.860 | 2.430 |
High resolution limit [Å] | 2.350 | 2.350 |
Rmerge | 0.070 | 0.851 |
Rmeas | 0.083 | 1.015 |
Rpim | 0.045 | 0.549 |
Number of reflections | 45799 | 4566 |
<I/σ(I)> | 9.3 | 1.5 |
Completeness [%] | 98.3 | 99.9 |
Redundancy | 3.4 | 3.3 |
CC(1/2) | 0.997 | 0.613 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.32 M Lithium chloride, 0.1 M Sodium citrate pH 5.5, 14 % w/v PEG 4000 |