8V9A
GII.NA1 Loreto 1257 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 | 2023-04-29 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.95373 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.704, 71.156, 78.386 |
Unit cell angles | 90.00, 110.04, 90.00 |
Refinement procedure
Resolution | 45.380 - 1.670 |
R-factor | 0.1865 |
Rwork | 0.185 |
R-free | 0.21280 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.035 |
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] | 45.380 | 1.690 |
High resolution limit [Å] | 1.670 | 1.670 |
Rmerge | 0.135 | 1.309 |
Rmeas | 0.153 | 1.481 |
Rpim | 0.071 | 0.683 |
Total number of observations | 344784 | 15533 |
Number of reflections | 75438 | 3505 |
<I/σ(I)> | 6.3 | 0.8 |
Completeness [%] | 99.5 | |
Redundancy | 4.6 | 4.4 |
CC(1/2) | 0.995 | 0.453 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | 0.2 M Magnesium chloride hexahydrate 0.1 M Tris (Ph 7.0) 10% w/v PEG 8000 |