7EKG
Structure of SARS-CoV-2 Beta variant spike receptor-binding domain complexed with human ACE2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-01-22 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97918 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 105.150, 105.150, 230.940 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 26.910 - 2.630 |
R-factor | 0.2156 |
Rwork | 0.214 |
R-free | 0.24840 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6lzg |
RMSD bond length | 0.004 |
RMSD bond angle | 0.621 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.19_4092) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.010 | 2.700 |
High resolution limit [Å] | 2.630 | 2.630 |
Number of reflections | 39380 | 39271 |
<I/σ(I)> | 21.9 | |
Completeness [%] | 99.0 | |
Redundancy | 21.8 | |
CC(1/2) | 1.000 | 0.744 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 291 | 0.1 M MES, pH 6.5, 12% w/v PEG 20000 |