5ZII
Crystal Structures of Mutant Endo-beta-1,4-xylanase II (Y88F)Complexed with Xylotriose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 80 |
Detector technology | CCD |
Collection date | 2017-12-07 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.822, 58.543, 69.590 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.911 - 1.300 |
R-factor | 0.1397 |
Rwork | 0.139 |
R-free | 0.15460 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2dfc |
RMSD bond length | 0.015 |
RMSD bond angle | 1.354 |
Data reduction software | XDS |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.911 | 1.346 |
High resolution limit [Å] | 1.300 | 1.300 |
Rmerge | 0.022 | 0.109 |
Number of reflections | 47482 | 4724 |
<I/σ(I)> | 27.26 | 6.1 |
Completeness [%] | 94.6 | 96.66 |
Redundancy | 6.5 | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 6 | 291 | 20% PEG 8000, 0.2M NaI, 0.1M MES |