7NIO
Crystal structure of the SARS-CoV-2 helicase APO form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-06-25 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9126 |
Spacegroup name | P 1 |
Unit cell lengths | 56.699, 70.118, 83.998 |
Unit cell angles | 104.31, 93.30, 112.16 |
Refinement procedure
Resolution | 80.240 - 2.200 |
R-factor | 0.2323 |
Rwork | 0.230 |
R-free | 0.28650 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6zsl |
RMSD bond length | 0.003 |
RMSD bond angle | 0.566 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.240 | 1.940 |
High resolution limit [Å] | 1.910 | 1.910 |
Rmeas | 0.132 | |
Number of reflections | 202027 | 8321 |
<I/σ(I)> | 4.4 | 0.2 |
Completeness [%] | 90.3 | |
Redundancy | 2.5 | |
CC(1/2) | 0.300 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | containing 20 % Ethylene Glycol, 10 % PEG 8K, 0.05 M MES pH 6.5, 0.05 M Imidazole pH 6.5, 10% v/v Ethylene glycols mix |