6Q8N
GH10 endo-xylanase in complex with xylobiose epoxide inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-04-24 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.968620 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 48.120, 75.750, 221.990 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 62.570 - 1.760 |
| R-factor | 0.16886 |
| Rwork | 0.167 |
| R-free | 0.20473 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3u7b |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.750 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 62.570 | 1.790 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Rpim | 0.044 | 0.690 |
| Number of reflections | 81568 | 4016 |
| <I/σ(I)> | 10.69 | 1.07 |
| Completeness [%] | 100.0 | |
| Redundancy | 7.95 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | Sodium/potassium phosphate (pH 6.9). Co-crystallisation with xylobiose epoxide inhibitor. |
