3ZLP
Crystal structure of Schistosoma mansoni Peroxiredoxin 1 C48P mutant form with four decamers in the asymmetric unit
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-06-28 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 95.179, 190.300, 211.995 |
| Unit cell angles | 90.00, 90.09, 90.00 |
Refinement procedure
| Resolution | 48.758 - 3.515 |
| R-factor | 0.276 |
| Rwork | 0.277 |
| R-free | 0.28930 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ztl |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.512 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.760 | 3.720 |
| High resolution limit [Å] | 3.520 | 3.510 |
| Rmerge | 0.280 | 1.480 |
| Number of reflections | 91789 | |
| <I/σ(I)> | 5.75 | 0.84 |
| Completeness [%] | 98.4 | 90.6 |
| Redundancy | 4.2 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 100 MM BIS-TRIS PROPANE, 200 MM NABR, 20% PEG 3350 |
