3ZJ6
Crystal of Raucaffricine Glucosidase in complex with inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE X11 |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | X11 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-02-15 |
| Detector | MARRESEARCH |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 103.146, 127.954, 215.204 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.860 - 2.400 |
| R-factor | 0.16502 |
| Rwork | 0.164 |
| R-free | 0.19890 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4atd |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.684 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | Auto-Rickshaw |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.440 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.150 | 0.760 |
| Number of reflections | 56755 | |
| <I/σ(I)> | 23.8 | 4.86 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 15 | 14.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 10% PEG4000, 0.3 M AMSO4 |
