9DQC
Hare calicivirus protruding domain and A-trisaccharide complex
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-07-02 |
| Detector | DECTRIS EIGER2 X 9M |
| Wavelength(s) | 0.95366 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 55.110, 82.526, 74.331 |
| Unit cell angles | 90.00, 90.96, 90.00 |
Refinement procedure
| Resolution | 44.620 - 1.420 |
| R-factor | 0.1556 |
| Rwork | 0.155 |
| R-free | 0.17760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.027 |
| 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] | 44.620 | 1.450 |
| High resolution limit [Å] | 1.420 | 1.420 |
| Rmerge | 0.069 | |
| Number of reflections | 123900 | 12078 |
| <I/σ(I)> | 6.9 | |
| Completeness [%] | 99.6 | |
| Redundancy | 4 | |
| CC(1/2) | 0.998 | 0.700 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.2 M lithium sulfate, 0.1 M Bis-Tris, pH 5.5, 20% w/v PEG3350, 60-molar excess of A-trisaccharide |
