9UCN
Monomer of SARS-CoV-2 nsp4CTD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-07-09 |
Detector | STFC Large Pixel Detector |
Wavelength(s) | 0.9793 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 56.880, 56.880, 78.030 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 28.440 - 1.440 |
R-factor | 0.2104 |
Rwork | 0.208 |
R-free | 0.23640 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 0.771 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX (1.20.1_4487) |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.580 | 1.480 |
High resolution limit [Å] | 1.440 | 1.440 |
Rmerge | 0.049 | 1.129 |
Number of reflections | 26910 | 1888 |
<I/σ(I)> | 1.55 | |
Completeness [%] | 99.9 | |
Redundancy | 1.55 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.8 M lithium sulfate monohydrate, 0.1 M sodium acetate trihydrate, at pH 4.6. |