8S0N
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 | 161.869, 54.458, 165.822 |
Unit cell angles | 90.00, 108.39, 90.00 |
Refinement procedure
Resolution | 24.420 - 2.300 |
R-factor | 0.2126 |
Rwork | 0.211 |
R-free | 0.24580 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.004 |
RMSD bond angle | 0.841 |
Data reduction software | XDS (0.6.6.0) |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.21_5207) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 2.390 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.240 | 2.236 |
Rmeas | 0.259 | 2.417 |
Rpim | 0.097 | 0.912 |
Number of reflections | 50880 | 2545 |
<I/σ(I)> | 6.6 | 0.9 |
Completeness [%] | 95.0 | 39.4 |
Redundancy | 7 | 6.9 |
CC(1/2) | 0.990 | 0.316 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 291 | 10 %w/v PEG 3000, 0.1 M imidazole (pH 8.0), 0.2 M lithium sulfate |