1YB6
Hydroxynitrile lyase from hevea brasiliensis in complex with mandelonitrile
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE BW7B |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | BW7B |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2001-06-08 |
Detector | MARRESEARCH |
Wavelength(s) | 0.8426 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 47.362, 106.553, 128.351 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 23.680 - 1.540 |
R-factor | 0.167 |
Rwork | 0.167 |
R-free | 0.18200 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 2yas |
RMSD bond length | 0.004 |
RMSD bond angle | 1.300 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 23.680 | 1.580 |
High resolution limit [Å] | 1.540 | 1.540 |
Number of reflections | 46599 | |
<I/σ(I)> | 28.1 | 7.6 |
Completeness [%] | 95.8 | 96 |
Redundancy | 4.9 |
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 |