8ENW
Crystal structure of beta'-COPI-WD40 domain in complex with SARS-CoV-2 clientized spike tail heptapeptide.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS-II BEAMLINE 17-ID-1 |
Synchrotron site | NSLS-II |
Beamline | 17-ID-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-12-14 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.92 |
Spacegroup name | P 1 |
Unit cell lengths | 42.711, 46.012, 84.319 |
Unit cell angles | 81.24, 81.52, 69.01 |
Refinement procedure
Resolution | 42.710 - 1.450 |
R-factor | 0.1546 |
Rwork | 0.153 |
R-free | 0.17960 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4j79 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.946 |
Data reduction software | HKL-3000 |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 82.910 | 1.470 |
High resolution limit [Å] | 1.450 | 1.450 |
Number of reflections | 100965 | 4966 |
<I/σ(I)> | 6.8 | |
Completeness [%] | 96.5 | 94.78 |
Redundancy | 3.7 | |
CC(1/2) | 0.996 | 0.620 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 295.15 | 0.1M MES pH 6.0, 15% PEG20000 |