7WNB
Crystal structure of SARS-CoV-2 spike receptor-binding domain (RBD) in complex with NCV2SG48 Fab
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-11-17 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9 |
Spacegroup name | P 21 2 21 |
Unit cell lengths | 87.297, 102.943, 114.341 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.648 - 2.180 |
R-factor | 0.2467 |
Rwork | 0.245 |
R-free | 0.28070 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7eam 7chp |
RMSD bond length | 0.008 |
RMSD bond angle | 0.966 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 102.940 | 2.240 |
High resolution limit [Å] | 2.180 | 2.180 |
Number of reflections | 54347 | 4404 |
<I/σ(I)> | 5.1 | 1.4 |
Completeness [%] | 99.8 | 99.9 |
Redundancy | 5.1 | |
CC(1/2) | 0.948 | 0.316 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.5 M ammonium sulfate, 19% PEG3350, 0.1 M Bis-Tris pH 5.5 |