8TCR
Structure of glucose bound Alistipes sp. 3-Keto-beta-glucopyranoside-1,2-Lyase AL1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08B1-1 |
Synchrotron site | CLSI |
Beamline | 08B1-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-02-02 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 1.1808 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 47.517, 113.679, 208.580 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.400 - 2.080 |
R-factor | 0.18429 |
Rwork | 0.182 |
R-free | 0.22898 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.694 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.400 | 2.130 |
High resolution limit [Å] | 2.080 | 2.080 |
Rmerge | 0.060 | 0.530 |
Rmeas | 0.085 | 0.749 |
Rpim | 0.060 | 0.530 |
Total number of observations | 130468 | 8537 |
Number of reflections | 68867 | 4460 |
<I/σ(I)> | 8.9 | 1.5 |
Completeness [%] | 99.8 | |
Redundancy | 1.9 | 1.9 |
CC(1/2) | 0.997 | 0.566 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 25% PEG 1500 0.13 M MIB pH 5 |