9EDO
GII.27: Loreto0959 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 | PIXEL |
| Collection date | 2024-07-20 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.95374 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 51.150, 90.560, 67.120 |
| Unit cell angles | 90.00, 106.34, 90.00 |
Refinement procedure
| Resolution | 49.080 - 1.420 |
| R-factor | 0.1354 |
| Rwork | 0.133 |
| R-free | 0.17460 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.774 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.090 | 1.440 |
| High resolution limit [Å] | 1.420 | 1.420 |
| Rmerge | 0.085 | 0.695 |
| Rmeas | 0.093 | 0.763 |
| Rpim | 0.038 | 0.311 |
| Total number of observations | 623429 | 26748 |
| Number of reflections | 109595 | 4837 |
| <I/σ(I)> | 9.7 | 1.7 |
| Completeness [%] | 99.3 | |
| Redundancy | 5.7 | 5.5 |
| CC(1/2) | 0.998 | 0.861 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291.15 | 0.17 M ammonium sulfate, 25.5% w/v PEG 4000 |
