6GHF
Crystal structure of a GST variant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-06-24 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9730 |
| Spacegroup name | P 43 |
| Unit cell lengths | 51.000, 51.000, 227.490 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 56.870 - 3.520 |
| R-factor | 0.29935 |
| Rwork | 0.295 |
| R-free | 0.33325 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4j2f |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.607 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.870 | 3.600 |
| High resolution limit [Å] | 3.500 | 3.500 |
| Rmeas | 0.099 | 1.380 |
| Number of reflections | 7132 | |
| <I/σ(I)> | 8.8 | 1.3 |
| Completeness [%] | 98.6 | 99 |
| Redundancy | 4.8 | |
| CC(1/2) | 0.998 | 0.656 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 289 | PEG 4000 20% (w/v), Na succinate 0.2 M, Hepes-NaOH 0.1 M |
