4WR5
Crystal Structure of GST Mutated with Halogenated Tyrosine (7cGST-1)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B2 |
Synchrotron site | SPring-8 |
Beamline | BL26B2 |
Temperature [K] | 90 |
Detector technology | CCD |
Collection date | 2012-12-18 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 1.00000 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 63.700, 63.700, 224.610 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 39.350 - 1.930 |
R-factor | 0.189 |
Rwork | 0.187 |
R-free | 0.23300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ua5 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.158 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE: 1.8.3_1479)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.000 | 2.040 |
High resolution limit [Å] | 1.925 | 1.930 |
Rmerge | 0.117 | 0.659 |
Number of reflections | 21466 | |
<I/σ(I)> | 22.69 | 5.04 |
Completeness [%] | 100.0 | 99.8 |
Redundancy | 20.811 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 2.0M AMMONIUM SULFATE, 0.1M MES PH 7.0 |