5MSY
Glycoside hydrolase BT_1012
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-10-22 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.92 |
Spacegroup name | H 3 2 |
Unit cell lengths | 262.455, 262.455, 184.883 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 38.950 - 2.300 |
R-factor | 0.1938 |
Rwork | 0.192 |
R-free | 0.22830 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3kzs |
RMSD bond length | 0.013 |
RMSD bond angle | 1.519 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.950 | 2.340 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.970 | |
Number of reflections | 106979 | |
<I/σ(I)> | 10.8 | 2.5 |
Completeness [%] | 99.5 | 100 |
Redundancy | 10.7 | 11 |
CC(1/2) | 0.529 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 40 % (v/v) MPD, 0.2 M ammonium phosphate and Tris pH 8.5 |