4NF7
Crystal structure of the GH5 family catalytic domain of Endo-1,4-beta-glucanase Cel5C from Butyrivibrio proteoclasticus.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-06-02 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.9537 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 68.890, 68.890, 175.640 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.446 - 2.111 |
R-factor | 0.1921 |
Rwork | 0.190 |
R-free | 0.23280 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.032 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.3.20) |
Phasing software | PHASER (2.4.0) |
Refinement software | PHENIX (1.7.3_928) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 64.133 | 37.446 | 2.230 |
High resolution limit [Å] | 2.110 | 6.680 | 2.110 |
Rmerge | 0.015 | 0.015 | |
Rmeas | 0.081 | 1.528 | |
Rpim | 0.016 | 0.301 | |
Total number of observations | 21217 | 83268 | |
Number of reflections | 24672 | ||
<I/σ(I)> | 11.8 | 32 | 2.5 |
Completeness [%] | 98.4 | 98.6 | 96 |
Redundancy | 27 | 23.3 | 24.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.6 | 289 | 20% PEG3350, 0.2M Ammonium formate pH 6.6, 20% PEG550 mme., VAPOR DIFFUSION, HANGING DROP, temperature 289K |