8V97
GII.17 CS-E1 norovirus protruding domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2023-06-16 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.95373 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.333, 72.025, 81.870 |
Unit cell angles | 90.00, 111.02, 90.00 |
Refinement procedure
Resolution | 45.260 - 1.270 |
R-factor | 0.1623 |
Rwork | 0.162 |
R-free | 0.17200 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 0.834 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.19.2_4158: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.260 | 1.290 |
High resolution limit [Å] | 1.270 | 1.270 |
Rmerge | 0.053 | 0.312 |
Rmeas | 0.059 | 0.349 |
Rpim | 0.025 | 0.152 |
Total number of observations | 934353 | 41548 |
Number of reflections | 177052 | 8244 |
<I/σ(I)> | 12.8 | 3 |
Completeness [%] | 99.7 | |
Redundancy | 5.3 | 5 |
CC(1/2) | 0.999 | 0.927 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | 0.2 M TMAO 0.1 M Tris (pH 8.5) 50% w/v PEG 2000 MME |