4CE6
Mutagenesis of a Rhodobacteraceae L-haloacid dehalogenase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 287 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 43.094, 68.875, 157.178 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.790 - 2.050 |
R-factor | 0.19732 |
Rwork | 0.194 |
R-free | 0.25309 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2yml |
RMSD bond length | 0.009 |
RMSD bond angle | 1.272 |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.790 | 2.140 |
High resolution limit [Å] | 2.050 | 2.050 |
Rmerge | 0.070 | 0.480 |
Number of reflections | 30452 | |
<I/σ(I)> | 12.5 | 2.6 |
Completeness [%] | 99.9 | 99.8 |
Redundancy | 5.5 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 0.2 M LICL, 0.1 M TRIS-HCL, 20% PEG 6000 PH 8.0 |