3LTO
Crystal structure of a mevalonate diphosphate decarboxylase from Legionella pneumophila
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X12C |
Synchrotron site | NSLS |
Beamline | X12C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-11-20 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.979 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 71.738, 88.824, 104.241 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.860 - 2.270 |
R-factor | 0.211 |
Rwork | 0.211 |
R-free | 0.25700 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.300 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXD |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.900 | 2.350 |
High resolution limit [Å] | 2.270 | 2.270 |
Rmerge | 0.120 | 0.393 |
Number of reflections | 30157 | |
<I/σ(I)> | 7.6 | 2.5 |
Completeness [%] | 99.6 | 96.1 |
Redundancy | 14.5 | 13 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 298 | 0.2M Ammonium Sulfate, 0.1M Sodium Acetate trihydrate, 30% PEG MME 2000, pH 4.6, VAPOR DIFFUSION, SITTING DROP, temperature 298.0K |