5D7B
Trigonal Crystal Structure of an acetylester hydrolase from Corynebacterium glutamicum
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-07-26 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.91841 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 143.393, 143.393, 197.783 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.529 - 3.200 |
| R-factor | 0.1872 |
| Rwork | 0.187 |
| R-free | 0.20100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2b61 |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.603 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.600 | 3.314 |
| High resolution limit [Å] | 3.200 | 3.200 |
| Rmerge | 1.010 | |
| Number of reflections | 39336 | |
| <I/σ(I)> | 24.66 | 2.66 |
| Completeness [%] | 99.9 | 99.95 |
| Redundancy | 9.5 | 9.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | Reservoir: 25.5 %(w/v) polyethylenglycol 4000, 15 %(v/v) glycerol, 0.17 M Lithium sulfate, 85 mM Tris/HCl, pH 8.5 Drop: 0.4 microliter reservoir solution plut 0.8 microliter protein solution with 5 mg/ml protein concentration |
