1YB7
Hydroxynitrile lyase from hevea brasiliensis in complex with 2,3-dimethyl-2-hydroxy-butyronitrile
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X11 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X11 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2000-09-12 |
Detector | MARRESEARCH |
Wavelength(s) | 0.9101 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 47.155, 106.553, 128.284 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.980 - 1.760 |
R-factor | 0.1721 |
Rwork | 0.172 |
R-free | 0.19700 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 2yas |
RMSD bond length | 0.005 |
RMSD bond angle | 1.200 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.980 | 1.820 |
High resolution limit [Å] | 1.760 | 1.760 |
Number of reflections | 31024 | |
<I/σ(I)> | 5.3 | 4.4 |
Completeness [%] | 96.0 | 96 |
Redundancy | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | AMMONIUM SULFATE, PEG 400, pH 7.50, VAPOR DIFFUSION, SITTING DROP, temperature 298K |