6IB7
Structure of wild type SuhB
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.2 |
Synchrotron site | BESSY |
Beamline | 14.2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-10-26 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.91841 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 90.718, 46.031, 72.915 |
Unit cell angles | 90.00, 125.40, 90.00 |
Refinement procedure
Resolution | 36.975 - 2.245 |
R-factor | 0.2172 |
Rwork | 0.215 |
R-free | 0.26050 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2qfl |
RMSD bond length | 0.005 |
RMSD bond angle | 0.736 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.380 |
High resolution limit [Å] | 2.245 | 2.245 |
Number of reflections | 11994 | 1919 |
<I/σ(I)> | 10.7 | 1.1 |
Completeness [%] | 97.2 | 96.8 |
Redundancy | 3.3 | 3.4 |
CC(1/2) | 0.990 | 0.580 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.3 | 291 | 0.1M Tris-HCl, pH 8.3, 12% PEG 8000, |