1KQ3
CRYSTAL STRUCTURE OF A GLYCEROL DEHYDROGENASE (TM0423) FROM THERMOTOGA MARITIMA AT 1.5 A RESOLUTION
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2001-05-29 |
Detector | ADSC QUANTUM 4 |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 105.730, 105.730, 135.790 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.500 |
R-factor | 0.173 |
Rwork | 0.173 |
R-free | 0.18900 |
Structure solution method | MAD |
RMSD bond length | 0.005 |
RMSD bond angle | 1.180 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | SOLVE |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.540 |
High resolution limit [Å] | 1.500 | 1.500 |
Number of reflections | 61417 | |
<I/σ(I)> | 9.1 | 2.8 |
Completeness [%] | 99.4 | 100 |
Redundancy | 4.5 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, sitting drop * | 6.2 | 293 | 35% MPD, 0.1M Na/k phosphate, pH 6.2, VAPOR DIFFUSION, SITTING DROP, temperature 293K, pH 6.20 |