4WR4
Crystal Structure of GST Mutated with Halogenated Tyrosine (7bGST-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 | 2013-02-08 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 1.00000 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 63.850, 63.850, 225.020 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 44.508 - 1.600 |
R-factor | 0.192 |
Rwork | 0.191 |
R-free | 0.22200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ua5 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.377 |
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] | 44.508 | 1.700 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.109 | 2.130 |
Number of reflections | 36508 | |
<I/σ(I)> | 17.2 | 1.31 |
Completeness [%] | 98.9 | 99.5 |
Redundancy | 13.81 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1M TRI-SODIUM CITRATE, 1.3M AMMONIUM SULFATE, 0.2M LITHIUM SULFATE |