2OZL
Human pyruvate dehydrogenase S264E variant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-06-20 |
Wavelength(s) | 1.200 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 64.900, 126.400, 190.400 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.900 |
R-factor | 0.1861 |
Rwork | 0.186 |
R-free | 0.22100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ni4 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.270 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 1.670 |
Rmerge | 0.080 |
Number of reflections | 106472 |
<I/σ(I)> | 5.56 |
Completeness [%] | 91.1 |
Redundancy | 3.23 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 295 | 14-18% PEG3350, 100-200mM NaSCN, 5mM DTT, 0.1mM NaN3,, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 295K |