7Z0X
THSC20.HVTR26 Fab bound to SARS-CoV-2 Receptor Binding Domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-02-11 |
Detector | DECTRIS EIGER2 XE 16M |
Wavelength(s) | 0.9795 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 90.286, 104.213, 89.064 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.800 |
R-factor | 0.1638 |
Rwork | 0.163 |
R-free | 0.18750 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | AlphaFold |
Data reduction software | autoPROC |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.860 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.019 | 0.309 |
Rmeas | 0.028 | 0.437 |
Rpim | 0.019 | 0.309 |
Number of reflections | 72244 | 72238 |
<I/σ(I)> | 20.3 | 2 |
Completeness [%] | 92.0 | 50 |
Redundancy | 2 | 2 |
CC(1/2) | 1.000 | 0.727 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7 | 293.15 | 15% (w/v) PEG 20,000, 100 mM HEPES / Sodium hydroxide pH 7.0 |