3WWG
Crystal structure of the N-glycan-deficient variant N448A of isopullulanase complexed with isopanose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NW12A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-06-02 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 96.400, 108.100, 116.000 |
| Unit cell angles | 90.00, 103.90, 90.00 |
Refinement procedure
| Resolution | 34.040 - 2.200 |
| R-factor | 0.18458 |
| Rwork | 0.183 |
| R-free | 0.22366 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1x0c |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.221 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.320 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.071 | 0.334 |
| Number of reflections | 114159 | |
| <I/σ(I)> | 3.6 | |
| Completeness [%] | 97.4 | 92.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.7 | 293 | 10% PEG8000, 50mM sodium acetate buffer, pH 4.7, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
