5YWK
Crystal structure of Arabidopsis thaliana HPPD complexed with Benquitrione-Methyl
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-09-10 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97881 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 95.753, 95.753, 194.584 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.519 - 2.804 |
R-factor | 0.2493 |
Rwork | 0.247 |
R-free | 0.29460 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1tfz |
RMSD bond length | 0.009 |
RMSD bond angle | 0.788 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.904 |
High resolution limit [Å] | 2.804 | 2.804 |
Rmerge | 0.140 | 0.242 |
Number of reflections | 22388 | 1120 |
<I/σ(I)> | 17.89 | |
Completeness [%] | 97.0 | |
Redundancy | 12.2 | 13 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 291.16 | 33% PEG 400, 0.1M sodium chloride, 0.1M Sodium acetate |