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 |
