4JRU
Structure of haze forming proteins in white wines: Vitis vinifera thaumatin-like proteins
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-11-22 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.956639 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 34.801, 70.168, 74.895 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 14.620 - 1.200 |
R-factor | 0.16735 |
Rwork | 0.166 |
R-free | 0.18444 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4H8T |
RMSD bond length | 0.027 |
RMSD bond angle | 2.345 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 14.907 | 1.260 |
High resolution limit [Å] | 1.200 | 1.200 |
Rmerge | 0.070 | |
Number of reflections | 51588 | |
<I/σ(I)> | 7 | |
Completeness [%] | 88.4 | 49.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | 0.1 M Na acetate pH 4.6, 6% PEG 4000, 10 mM MgCl2, VAPOR DIFFUSION, HANGING DROP, temperature 293K |