4Z0J
F96S/S73A Double 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 | 2009-09-29 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 53.480, 50.840, 88.260 |
Unit cell angles | 90.00, 91.74, 90.00 |
Refinement procedure
Resolution | 53.450 - 2.070 |
R-factor | 0.21873 |
Rwork | 0.216 |
R-free | 0.26011 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2vfd |
RMSD bond length | 0.006 |
RMSD bond angle | 1.078 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 53.450 | 2.200 |
High resolution limit [Å] | 2.070 | 2.070 |
Rmerge | 0.360 | |
Number of reflections | 29180 | |
<I/σ(I)> | 7 | 2.8 |
Completeness [%] | 98.9 | 93 |
Redundancy | 3.3 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 293 | NaOAc, 10mM Li2SO4, 0.5mM DTT, 0.5mM NaN3, 0.5mM EDTA, 28% PEG 1450 |