5TKP
Crystal structure of FBP aldolase from Toxoplasma gondii, equilibrium Schiff base FBP complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-03-27 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.1 |
Spacegroup name | P 42 21 2 |
Unit cell lengths | 109.120, 109.120, 54.800 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.090 |
R-factor | 0.1643 |
Rwork | 0.160 |
R-free | 0.21130 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.006 |
RMSD bond angle | 0.942 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHENIX |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.130 |
High resolution limit [Å] | 2.090 | 5.670 | 2.090 |
Rmerge | 0.084 | 0.040 | 0.883 |
Rmeas | 0.087 | ||
Rpim | 0.030 | ||
Total number of observations | 154302 | ||
Number of reflections | 19184 | ||
<I/σ(I)> | 8.4 | ||
Completeness [%] | 95.1 | 99.9 | 61.6 |
Redundancy | 8 | 11 | 3.3 |
CC(1/2) | 0.999 | 0.491 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 296 | 0.1M Sodium Acetate, 0.2M Lithium Sulfate, 3.5% PEG 8000, 10% PEG 1000 |