2WOA
MMP12 complex with a beta hydroxy carboxylic acid
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX14.1 |
Synchrotron site | SRS |
Beamline | PX14.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-05-21 |
Detector | ADSC CCD |
Spacegroup name | P 1 |
Unit cell lengths | 46.156, 65.339, 68.332 |
Unit cell angles | 66.11, 84.12, 71.46 |
Refinement procedure
Resolution | 19.730 - 2.300 |
R-factor | 0.157 |
Rwork | 0.153 |
R-free | 0.21900 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.013 |
RMSD bond angle | 1.497 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.4.0073) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.060 | 0.160 |
Number of reflections | 28212 | |
<I/σ(I)> | 12.27 | 4.63 |
Completeness [%] | 91.8 | 58.9 |
Redundancy | 1.94 | 1.89 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.2 | 100MM MES PH5.2-5.6, 16-20% PEG, 5KMME, 200MM AMMONIUM SULPHATE |