2ZL6
Atomic resolution structural characterization of recognition of histo-blood group antigens by 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] | 100 |
Detector technology | CCD |
Collection date | 2007-08-05 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97942 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 83.512, 83.512, 162.929 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 40.450 - 1.430 |
R-factor | 0.18023 |
Rwork | 0.179 |
R-free | 0.20048 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ihm |
RMSD bond length | 0.012 |
RMSD bond angle | 1.391 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.730 | 1.480 |
High resolution limit [Å] | 1.430 | 1.430 |
Rmerge | 0.070 | 0.532 |
Number of reflections | 121303 | |
<I/σ(I)> | 8.9 | 2.5 |
Completeness [%] | 99.7 | 99.1 |
Redundancy | 5.38 | 5.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 3.8 | 293 | 0.1M Citric Acid(pH 3.8), 0.2M Ammonium Nitrate, 20% PEG 3350, VAPOR DIFFUSION, HANGING DROP, temperature 293K |