8UMJ
Wild type EPSP synthase complexed with glyphosate and shikimate-3-phosphate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-02-20 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.03317 |
Spacegroup name | P 1 |
Unit cell lengths | 46.518, 63.282, 69.964 |
Unit cell angles | 84.76, 85.51, 85.55 |
Refinement procedure
Resolution | 48.740 - 1.930 |
R-factor | 0.1751 |
Rwork | 0.174 |
R-free | 0.20840 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 0.745 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.18rc3_3805: ???)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.960 |
High resolution limit [Å] | 1.930 | 5.240 | 1.930 |
Rmerge | 0.034 | 0.291 | |
Rmeas | 0.047 | 0.404 | |
Rpim | 0.032 | 0.280 | |
Number of reflections | 50866 | 2644 | 1940 |
<I/σ(I)> | 5.4 | ||
Completeness [%] | 85.6 | 88.8 | 65.8 |
Redundancy | 1.9 | 2 | 1.4 |
CC(1/2) | 0.802 | 0.995 | 0.802 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 298 | 0.1M MES pH 6.5, 25% PEG 8000 |