3PY2
Structure of C126S mutant of Plasmodium falciparum triosephosphate isomerase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2009-10-31 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.541 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 50.810, 173.790, 53.510 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.450 - 1.930 |
| R-factor | 0.17471 |
| Rwork | 0.172 |
| R-free | 0.22043 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.897 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.770 | 1.980 |
| High resolution limit [Å] | 1.930 | 1.930 |
| Rmerge | 0.082 | |
| Number of reflections | 31243 | |
| <I/σ(I)> | 8.39 | |
| Completeness [%] | 85.0 | 77.99 |
| Redundancy | 6.67 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 24% PEG, 1M HEPES bufffer (pH 7.0), 10mM Lithium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
