2YN4
L-2-chlorobutryic acid bound complex L-haloacid dehalogenase from a Rhodobacteraceae family bacterium
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 42.670, 68.580, 157.980 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 26.350 - 1.740 |
| R-factor | 0.16438 |
| Rwork | 0.162 |
| R-free | 0.20268 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2yml |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.433 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 79.000 | 1.790 |
| High resolution limit [Å] | 1.740 | 1.740 |
| Rmerge | 0.060 | 0.400 |
| Number of reflections | 47997 | |
| <I/σ(I)> | 14.8 | 2.1 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
