3MP2
Crystal structure of transmissible gastroenteritis virus papain-like protease 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-12-11 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.873 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 62.510, 62.510, 199.420 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.150 - 2.500 |
R-factor | 0.176 |
Rwork | 0.173 |
R-free | 0.22300 |
Structure solution method | SAD |
RMSD bond length | 0.022 |
RMSD bond angle | 1.903 |
Data scaling software | XSCALE |
Phasing software | Auto-Rickshaw |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.650 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.159 | 0.778 |
Number of reflections | 14461 | 3956 |
<I/σ(I)> | 9.72 | 2 |
Completeness [%] | 99.2 | 95.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 292 | MES, ammonium sulphate, PEG 5000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 292K |