8R85
Xylanase from Bacillus circulans mutant E78Q/W9A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-11-11 |
Detector | DECTRIS EIGER2 S 9M |
Wavelength(s) | 0.8731 |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 43.001, 52.623, 72.512 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.630 - 1.300 |
R-factor | 0.13891 |
Rwork | 0.137 |
R-free | 0.17197 |
Structure solution method | MOLECULAR REPLACEMENT |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.630 | 1.320 |
High resolution limit [Å] | 1.300 | 1.300 |
Number of reflections | 40663 | 1806 |
<I/σ(I)> | 12.2 | 1.2 |
Completeness [%] | 98.8 | 90.6 |
Redundancy | 1.8 | |
CC(1/2) | 0.999 | 0.544 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 18.182 %v/v PEGSH 0.1 M BICINE 9.16 pH |