2WO9
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 | 2002-05-22 |
Detector | ADSC QUANTUM 4 |
Spacegroup name | P 1 |
Unit cell lengths | 46.352, 65.291, 69.356 |
Unit cell angles | 66.15, 83.84, 71.38 |
Refinement procedure
Resolution | 19.880 - 1.700 |
R-factor | 0.17449 |
Rwork | 0.172 |
R-free | 0.21754 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.014 |
RMSD bond angle | 1.416 |
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 | 1.760 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.050 | 0.270 |
Number of reflections | 62267 | |
<I/σ(I)> | 13.9 | 2.7 |
Completeness [%] | 81.2 | 50.8 |
Redundancy | 1.87 | 1.85 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.2 | 100MM MES PH5.2-5.6, 16-20% PEG, 5KMME, 200MM AMMONIUM SULPHATE |