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 |