8AIB
R11A variant of glutathione transferase Chi 1 from Synechocystis sp. PCC 6803 in complex with glutathione
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM07 |
Synchrotron site | ESRF |
Beamline | BM07 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-10-11 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97951 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 92.196, 92.196, 193.088 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 31.350 - 2.200 |
R-factor | 0.2166 |
Rwork | 0.215 |
R-free | 0.24220 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 8ai8 |
RMSD bond length | 0.008 |
RMSD bond angle | 0.940 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | BUSTER (2.10.4) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.100 | 2.270 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.100 | 1.086 |
Number of reflections | 39298 | 2006 |
<I/σ(I)> | 18.4 | 2.4 |
Completeness [%] | 91.3 | |
Redundancy | 12.8 | |
CC(1/2) | 0.999 | 0.851 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 277 | 16% (w/v) PEG 8000, 40 mM potassium phosphate monobasic and 20% (w/v) glycerol |