8R86
Xylanase from Bacillus circulans mutant E78Q/W71A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-07-23 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.965459 |
| Spacegroup name | P 1 |
| Unit cell lengths | 39.787, 39.899, 53.653 |
| Unit cell angles | 85.26, 81.43, 63.26 |
Refinement procedure
| Resolution | 27.810 - 1.500 |
| R-factor | 0.13898 |
| Rwork | 0.137 |
| R-free | 0.17302 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.511 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0352) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.810 | 1.530 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Number of reflections | 42397 | 2153 |
| <I/σ(I)> | 9.8 | |
| Completeness [%] | 90.6 | |
| Redundancy | 1.5 | |
| CC(1/2) | 0.986 | 0.943 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 20.727 %v/v PEGSH, 0.1 M BICINE 8.81 pH |
