7UFL
Crystal structure of chimeric omicron RBD (strain BA.2) complexed with chimeric mouse ACE2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-1 |
Synchrotron site | SSRL |
Beamline | BL12-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-02-23 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 0.979 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 80.048, 118.467, 110.845 |
Unit cell angles | 90.00, 93.65, 90.00 |
Refinement procedure
Resolution | 30.390 - 2.840 |
R-factor | 0.2167 |
Rwork | 0.214 |
R-free | 0.27090 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 6vw1 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.603 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.852 | 3.200 |
High resolution limit [Å] | 2.840 | 2.840 |
Rmerge | 0.061 | 0.563 |
Number of reflections | 26691 | 1335 |
<I/σ(I)> | 10 | |
Completeness [%] | 54.5 | |
Redundancy | 3.7 | |
CC(1/2) | 0.999 | 0.757 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 100 mM Tris, pH 8.5, 18-22% PEG6000, 100 mM sodium chloride |