7D6I
A neutralizing MAb targeting receptor-binding-domain of SARS-CoV-2
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 | 2020-04-10 |
Detector | DECTRIS PILATUS 300K |
Wavelength(s) | 0.97919 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 150.605, 150.605, 121.320 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.300 - 3.410 |
R-factor | 0.2271 |
Rwork | 0.226 |
R-free | 0.25510 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6lzg |
RMSD bond length | 0.004 |
RMSD bond angle | 0.803 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER (2.5.6) |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.300 | 3.620 |
High resolution limit [Å] | 3.410 | 3.410 |
Number of reflections | 15877 | 800 |
<I/σ(I)> | 12.6 | |
Completeness [%] | 100.0 | |
Redundancy | 36.1 | |
CC(1/2) | 0.993 | 0.733 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 291 | 50 mM Calcium chloride dihydrate, 100 mM BIS-TRIS pH 6.5, 30% v/v Polyethylene glycol and monomethyl ether 550 |