7P0X
Crystal structure of Thioredoxin reductase from Brugia Malayi
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 11.2C |
| Synchrotron site | ELETTRA |
| Beamline | 11.2C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-07-22 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 146.921, 258.985, 129.067 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.900 - 2.550 |
| R-factor | 0.1987 |
| Rwork | 0.197 |
| R-free | 0.23750 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3QFA_A 4tr1 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.564 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.900 | 2.600 |
| High resolution limit [Å] | 2.550 | 2.550 |
| Rmerge | 0.032 | 0.820 |
| Number of reflections | 80241 | 4505 |
| <I/σ(I)> | 28.8 | 2.3 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 6.6 | 6.8 |
| CC(1/2) | 1.000 | 0.800 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 294.15 | 22% MPD, 0.1M Tris/HCl pH8, 5mM DTT |
