2RLC
Crystal Structure of the Conjugated Bile Acid Hydrolase from Clostridium perfringens in Complex with Reaction Products Glycine and Cholate
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 | 2007-07-17 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.91841 |
| Spacegroup name | P 42 2 2 |
| Unit cell lengths | 64.240, 64.240, 169.900 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.800 |
| R-factor | 0.195 |
| Rwork | 0.193 |
| R-free | 0.22700 |
| Structure solution method | SAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.009 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | SHARP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.900 | |
| High resolution limit [Å] | 1.800 | 10.000 | 1.800 |
| Rmerge | 0.064 | 0.024 | 0.310 |
| Number of reflections | 62897 | 324 | 9412 |
| <I/σ(I)> | 18.34 | 48.1 | 5.1 |
| Completeness [%] | 99.8 | 85 | 100 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 291 | 10 mM BisTris pH 5.5, 20 mM ammonium sulfate, 25% PEG 3350, 10 mM Na-Glycocholate, VAPOR DIFFUSION, SITTING DROP, temperature 291K |
