6GIO
Structure of Amino Acid Amide Racemase from Ochrobactrum anthropi
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 120 |
Detector technology | PIXEL |
Collection date | 2015-07-25 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.97949 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 64.600, 134.980, 88.770 |
Unit cell angles | 90.00, 90.25, 90.00 |
Refinement procedure
Resolution | 64.600 - 1.870 |
R-factor | 0.18715 |
Rwork | 0.185 |
R-free | 0.23047 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5m46 |
RMSD bond length | 0.013 |
RMSD bond angle | 1.519 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0218) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 64.600 | 1.920 |
High resolution limit [Å] | 1.870 | 1.870 |
Rmerge | 0.110 | 0.920 |
Rpim | 0.090 | 0.770 |
Number of reflections | 123230 | 9034 |
<I/σ(I)> | 7.6 | 1.4 |
Completeness [%] | 98.5 | 97.9 |
Redundancy | 4.2 | 4.2 |
CC(1/2) | 1.000 | 0.550 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 0.1 M HEPES, pH 7.0 2ith 0.2 M MgCl2 and 25% (w/v) PEG 3350 |