5XUN
Crystal structure of Y145F mutant of KacT
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-02-27 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.97928 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 52.869, 52.869, 255.296 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 28.527 - 2.000 |
R-factor | 0.2068 |
Rwork | 0.205 |
R-free | 0.24720 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5fvj |
RMSD bond length | 0.006 |
RMSD bond angle | 1.019 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.110 | 0.490 |
Number of reflections | 29178 | 2829 |
<I/σ(I)> | 16 | 2.6 |
Completeness [%] | 99.5 | 98.5 |
Redundancy | 8.4 | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 296 | 0.2 M Sodium acetate trihydrate, 20% (w/v) PEG3350 |