6GIB
Crystal structure of glutathione transferase Omega 2S from Trametes versicolor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM30A |
Synchrotron site | ESRF |
Beamline | BM30A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-12-21 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97953 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 58.959, 93.023, 96.024 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.012 - 2.194 |
R-factor | 0.1991 |
Rwork | 0.196 |
R-free | 0.25840 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6f43 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.055 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.020 | 2.330 |
High resolution limit [Å] | 2.190 | 2.190 |
Rmerge | 0.100 | 0.620 |
Number of reflections | 27630 | 4309 |
<I/σ(I)> | 16.5 | |
Completeness [%] | 99.7 | 98.4 |
Redundancy | 7.2 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | 10.7% PEG4000, 0.1 M pH 7.0 HEPES-MES buffer (in the ratio 4:6, respectively), 0.05 M sodium acetate and 0.05 M magnesium chloride |