6NE9
Bacteroides intestinalis acetyl xylan esterase (BACINT_01039)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-10-28 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.979 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 116.703, 126.553, 110.260 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.598 - 1.738 |
R-factor | 0.1846 |
Rwork | 0.183 |
R-free | 0.21690 |
Structure solution method | SAD |
RMSD bond length | 0.004 |
RMSD bond angle | 0.927 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | AutoSol |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.600 | 1.800 |
High resolution limit [Å] | 1.738 | 1.738 |
Rmerge | 0.061 | 0.229 |
Number of reflections | 145030 | 2851 |
<I/σ(I)> | 15.3 | |
Completeness [%] | 91.7 | 28.61 |
Redundancy | 1.9 | 1.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 10 mM Ammonium sulfate, 80 mM Sodium Cacodylate pH 6.5, and 21% PEG4000 |