3U14
Structure of D50A-fructofuranosidase from Schwanniomyces occidentalis complexed with inulin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2010-12-09 |
| Detector | ADSC QUANTUM 210 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 66.980, 107.670, 96.460 |
| Unit cell angles | 90.00, 91.92, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.240 |
| R-factor | 0.1956 |
| Rwork | 0.194 |
| R-free | 0.23146 |
| Structure solution method | Molecular Replacement & FOURIER SYNTHESIS |
| Starting model (for MR) | 3kf3 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.798 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 107.670 | 2.360 |
| High resolution limit [Å] | 2.240 | 2.240 |
| Rmerge | 0.140 | 0.500 |
| Number of reflections | 65603 | |
| <I/σ(I)> | 3.3 | |
| Completeness [%] | 98.4 | 98.2 |
| Redundancy | 5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIQUID DIFFUSION | 8 | 293 | 15% PEG 6000, 3% MPD, 0.2M MgCl2, 0.1M HCl-Tris pH 8, LIQUID DIFFUSION, temperature 293K |
