6T7G
Bacteroides salyersiae GH164 beta-mannosidase in complex with mannoimidazole
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-07-28 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 0.976230 |
Spacegroup name | P 1 |
Unit cell lengths | 69.710, 104.743, 170.568 |
Unit cell angles | 92.29, 97.27, 106.30 |
Refinement procedure
Resolution | 168.660 - 1.800 |
Rwork | 0.206 |
R-free | 0.23120 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6t5o |
RMSD bond length | 0.008 |
RMSD bond angle | 1.427 |
Data reduction software | xia2 |
Data scaling software | DIALS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0257) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 168.660 | 1.830 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 424506 | 21158 |
<I/σ(I)> | 6.9 | |
Completeness [%] | 100.0 | |
Redundancy | 2 | |
CC(1/2) | 0.998 | 0.666 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | ammonium tartrate, PEG 3350 |