7BEU
Human glutathione transferase M1-1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1) |
| Synchrotron site | PETRA III, EMBL c/o DESY |
| Beamline | P13 (MX1) |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-06-06 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.0332 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 49.118, 211.188, 49.435 |
| Unit cell angles | 90.00, 116.23, 90.00 |
Refinement procedure
| Resolution | 52.800 - 1.590 |
| R-factor | 0.1896 |
| Rwork | 0.188 |
| R-free | 0.22580 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1gtu |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.857 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 52.800 | 1.650 |
| High resolution limit [Å] | 1.590 | 1.590 |
| Rmeas | 0.064 | 0.470 |
| Number of reflections | 112127 | 8772 |
| <I/σ(I)> | 10.6 | 2 |
| Completeness [%] | 93.4 | 73.1 |
| Redundancy | 2.8 | 2.1 |
| CC(1/2) | 1.000 | 0.780 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 289 | HEPES 0.1 M (pH: 7.2), PEG 6000 18% (w/v) and ammonium chloride 0.2 M |
