4IN1
Structural Basis of Substrate Specificity and Protease Inhibition in Norwalk Virus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 77 |
Detector technology | CCD |
Collection date | 2011-03-12 |
Detector | ADSC QUANTUM 315 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 124.197, 124.197, 49.680 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 35.850 - 2.050 |
R-factor | 0.165 |
Rwork | 0.163 |
R-free | 0.20100 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.015 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.7_650)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.090 |
High resolution limit [Å] | 2.050 | 2.050 |
Rmerge | 0.105 | |
Number of reflections | 14341 | |
Completeness [%] | 97.6 | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.8 | 293.15 | 1.9 M lithium sulfate and 0.1 M sodium cacodylate, 25% glycerol, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 293.15K |