7QIF
Crystal structure of SARS-CoV-2 NSP14 in complex with 7MeGpppG.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-12-10 |
Detector | DECTRIS EIGER R 4M |
Wavelength(s) | 0.97625 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 67.336, 67.314, 138.585 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 69.290 - 2.530 |
R-factor | 0.211 |
Rwork | 0.207 |
R-free | 0.24650 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7qgi |
RMSD bond length | 0.002 |
RMSD bond angle | 0.466 |
Data reduction software | DIALS |
Data scaling software | STARANISO |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 69.300 | 2.730 |
High resolution limit [Å] | 2.530 | 2.530 |
Rmerge | 0.585 | |
Number of reflections | 12041 | 602 |
<I/σ(I)> | 6 | 1.6 |
Completeness [%] | 91.7 | 65.9 |
Redundancy | 26.5 | 27.6 |
CC(1/2) | 0.986 | 0.747 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277.15 | 1.26M sodium phosphate monobasic, 0.14M potassium phosphate dibasic |