8HGU
Epoxide hydrolase from Bosea sp. PAMC 26642
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 7A (6B, 6C1) |
Synchrotron site | PAL/PLS |
Beamline | 7A (6B, 6C1) |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2022-04-27 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.9793 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 87.537, 84.913, 98.235 |
Unit cell angles | 90.00, 100.91, 90.00 |
Refinement procedure
Resolution | 30.200 - 1.940 |
R-factor | 0.1739 |
Rwork | 0.172 |
R-free | 0.20780 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ehy |
RMSD bond length | 0.015 |
RMSD bond angle | 1.748 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.980 |
High resolution limit [Å] | 1.940 | 1.950 |
Rmerge | 0.110 | 0.410 |
Number of reflections | 101095 | 4384 |
<I/σ(I)> | 29.96 | 4.23 |
Completeness [%] | 97.6 | 85.3 |
Redundancy | 4.4 | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 296.15 | 1 M Ammonium formate, 0.1 M Sodium acetate pH 5.0, 8 % w/v PGA (Na+ form, LM) |