4NAX
Crystal structure of glutathione transferase PPUT_1760 from Pseudomonas putida, target EFI-507288, with one glutathione disulfide bound per one protein subunit
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X29A |
| Synchrotron site | NSLS |
| Beamline | X29A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-10-17 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 59.342, 66.620, 119.821 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.301 |
| R-factor | 0.10146 |
| Rwork | 0.101 |
| R-free | 0.13123 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4mf6 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.431 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.320 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.660 | |
| Number of reflections | 116741 | |
| <I/σ(I)> | 9.7 | 2.5 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 7.9 | 7.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | Protein in 10 mM HEPES, PH 7.5, 150 mM sodium chloride, 5% glycerol, reservoir: 20% peg1500, 20% glycerol, 5 MM GSH, cryoprotectant: NONE, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 298K |
