4MBT
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 MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-11-22 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.97946 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 122.560, 52.600, 91.610 |
| Unit cell angles | 90.00, 130.02, 90.00 |
Refinement procedure
| Resolution | 8.920 - 1.650 |
| R-factor | 0.22525 |
| Rwork | 0.224 |
| R-free | 0.25687 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4l5h |
| RMSD bond length | 0.027 |
| RMSD bond angle | 2.284 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 23.460 | 23.460 | 1.690 |
| High resolution limit [Å] | 1.600 | 5.060 | 1.600 |
| Rmerge | 0.060 | 0.411 | |
| Number of reflections | 53130 | ||
| <I/σ(I)> | 8 | 1.8 | |
| Completeness [%] | 90.2 | 81.2 | 94.3 |
| Redundancy | 2.8 | 2.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 2.58 M Mg acetate, 0.2 M MES, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
