6QSD
Crystal structure of Pizza6S
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-02-16 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.97857 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.787, 56.425, 69.918 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.905 - 1.450 |
R-factor | 0.1736 |
Rwork | 0.172 |
R-free | 0.20910 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ww9 |
RMSD bond length | 0.013 |
RMSD bond angle | 1.313 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.910 | 1.470 |
High resolution limit [Å] | 1.450 | 1.450 |
Rpim | 0.055 | 0.320 |
Number of reflections | 33717 | |
<I/σ(I)> | 9.7 | 2.1 |
Completeness [%] | 96.8 | 95 |
Redundancy | 7.6 | |
CC(1/2) | 0.849 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 9 | 293.15 | 0.1M BICINE pH 9.0, 1.6M Ammonium Sulfate |