3I1K
Structure of porcine torovirus Hemagglutinin-Esterase
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 | 2007-03-11 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.8726 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 156.307, 104.528, 97.473 |
Unit cell angles | 90.00, 95.79, 90.00 |
Refinement procedure
Resolution | 48.490 - 2.100 |
R-factor | 0.17252 |
Rwork | 0.171 |
R-free | 0.20463 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3cl4 |
RMSD bond length | 0.015 |
RMSD bond angle | 1.567 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 58.000 | 2.210 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.116 | 0.721 |
Number of reflections | 90957 | |
<I/σ(I)> | 8.4 | 2.2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 3.8 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.2M potassium acetate, 18% (w/v) PEG 3350, VAPOR DIFFUSION, HANGING DROP, temperature 291.0K |