2P3Z
Crystal structure of L-Rhamnonate dehydratase from Salmonella typhimurium
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 31-ID |
| Synchrotron site | APS |
| Beamline | 31-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-03-26 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.97900 |
| Spacegroup name | F 4 3 2 |
| Unit cell lengths | 272.248, 272.248, 272.248 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.650 - 1.800 |
| R-factor | 0.20351 |
| Rwork | 0.201 |
| R-free | 0.25235 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2gsh |
| RMSD bond length | 0.022 |
| RMSD bond angle | 1.788 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.3.0034) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.830 |
| High resolution limit [Å] | 1.770 | 3.810 | 1.770 |
| Rmerge | 0.086 | 0.041 | 0.678 |
| Number of reflections | 83847 | ||
| <I/σ(I)> | 8.3 | ||
| Completeness [%] | 99.9 | 99.5 | 100 |
| Redundancy | 21.1 | 20.9 | 16.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 295 | 60% v/v tacsimate, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
