5LC6
Crystal structure of a single chain monellin mutant: Q28K/C41S/Y65R-MNEI
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 5.2R |
| Synchrotron site | ELETTRA |
| Beamline | 5.2R |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-07-22 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.065 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 129.300, 30.990, 45.500 |
| Unit cell angles | 90.00, 106.17, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.700 |
| R-factor | 0.19055 |
| Rwork | 0.188 |
| R-free | 0.22931 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2o9u |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.921 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 50.000 |
| High resolution limit [Å] | 1.700 |
| Number of reflections | 18905 |
| <I/σ(I)> | 12.7 |
| Completeness [%] | 96.9 |
| Redundancy | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 30% PEG4K, 0.1 M sodium acetate at pH 4.6 and 0.2 M ammonium sulfate |
