6HZF
BP0997, GH138 enzyme targeting pectin rhamnogalacturonan II
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 | 2016-12-17 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97835 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 69.785, 106.207, 138.504 |
Unit cell angles | 90.00, 99.44, 90.00 |
Refinement procedure
Resolution | 49.550 - 1.950 |
R-factor | 0.1744 |
Rwork | 0.173 |
R-free | 0.20799 |
Structure solution method | SAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.698 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | SHELXCD |
Refinement software | REFMAC (5.8.0232) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.550 | 1.980 |
High resolution limit [Å] | 1.950 | 1.950 |
Number of reflections | 144883 | |
<I/σ(I)> | 19.7 | 2.5 |
Completeness [%] | 99.9 | 99.6 |
Redundancy | 12.7 | 10.8 |
CC(1/2) | 0.999 | 0.809 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 30 mM Glutamate, 30 mM Alanine, 30 mM Glycine, 30 mM Lysine, 30 mM Serine, 100 mM Tris/Bicine pH 8.5, 8 % Ethylene glycol, 16 % PEG 8000 |