8S0L
Crystal structure of the TMPRSS2 zymogen in complex with the nanobody A07
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-03-18 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.978565 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 182.665, 53.808, 65.477 |
Unit cell angles | 90.00, 100.74, 90.00 |
Refinement procedure
Resolution | 24.820 - 1.800 |
R-factor | 0.1786 |
Rwork | 0.177 |
R-free | 0.21540 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.013 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 1.850 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.106 | 2.643 |
Number of reflections | 58045 | 4194 |
<I/σ(I)> | 9.2 | 0.6 |
Completeness [%] | 99.8 | 98.3 |
Redundancy | 6.4 | 6.3 |
CC(1/2) | 0.998 | 0.293 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291 | 20 %w/v PEG 3350, 0.05 M HEPES (pH 7.0), 1 %w/v Tryptone, 0.001 %w/v NaN3 |