8ET5
Crystal structure of arabidopsis thaliana acetohydroxyacid synthase S653T mutant in complex with amidosulfuron
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-10-02 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.954 |
Spacegroup name | P 64 2 2 |
Unit cell lengths | 179.593, 179.593, 184.772 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 48.280 - 2.940 |
R-factor | 0.1897 |
Rwork | 0.188 |
R-free | 0.21710 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5k2o |
RMSD bond length | 0.001 |
RMSD bond angle | 0.721 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.280 | 3.070 |
High resolution limit [Å] | 2.940 | 2.940 |
Rpim | 0.046 | 0.369 |
Number of reflections | 37732 | 4382 |
<I/σ(I)> | 12.4 | 1.6 |
Completeness [%] | 99.6 | |
Redundancy | 14.6 | |
CC(1/2) | 0.998 | 0.835 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9.8 | 293 | CHES buffer, potassium sodium tartrate, sodium sulfate |