3M49
Crystal Structure of Transketolase Complexed with Thiamine Diphosphate from Bacillus anthracis
Replaces: 3K95Experimental procedure
Experimental method | SAD |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-07-12 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.9794 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 83.333, 132.087, 137.319 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 31.732 - 2.000 |
R-factor | 0.139 |
Rwork | 0.137 |
R-free | 0.17200 |
Structure solution method | SAD |
RMSD bond length | 0.012 |
RMSD bond angle | 1.278 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | HKL-3000 |
Refinement software | PHENIX ((phenix.refine: 1.6_289)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.030 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 103149 | |
<I/σ(I)> | 9 | 6.5 |
Completeness [%] | 100.0 | 100 |
Redundancy | 8 | 7.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 291 | 0.2 M Ammomium sulfate, 0.1 M Bis-Tris pH 6.5, 25% PEG 3350, VAPOR DIFFUSION, SITTING DROP, temperature 291K |