3TS3
Crystal structure of the projection domain of the turkey astrovirus capsid protein at 1.5 angstrom resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-BM |
Synchrotron site | APS |
Beamline | 22-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-08-24 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.487, 127.878, 71.007 |
Unit cell angles | 90.00, 104.49, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.490 |
R-factor | 0.1776 |
Rwork | 0.176 |
R-free | 0.20530 |
Structure solution method | SAD |
RMSD bond length | 0.008 |
RMSD bond angle | 1.179 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.540 |
High resolution limit [Å] | 1.490 | 3.210 | 1.490 |
Rmerge | 0.066 | 0.030 | 0.391 |
Number of reflections | 124746 | ||
<I/σ(I)> | 8.8 | ||
Completeness [%] | 99.9 | 99.8 | 99.2 |
Redundancy | 5.8 | 6 | 4.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 291 | PEG 4000, ammonium sulfate, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 291K |