4CNQ
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 | 42.870, 68.950, 156.800 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.550 - 1.840 |
R-factor | 0.17511 |
Rwork | 0.172 |
R-free | 0.22735 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2yml |
RMSD bond length | 0.008 |
RMSD bond angle | 1.330 |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.550 | 8.250 |
High resolution limit [Å] | 1.890 | 1.840 |
Rmerge | 0.070 | 0.770 |
Number of reflections | 259162 | |
<I/σ(I)> | 18.4 | 2.2 |
Completeness [%] | 99.9 | 100 |
Redundancy | 6.3 | 6.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4.5 | pH 4.5 |