4DPE
Structure of MMP3 complexed with a platinum-based inhibitor.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-07-11 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.976 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 38.206, 77.714, 105.615 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.860 - 1.960 |
R-factor | 0.18443 |
Rwork | 0.180 |
R-free | 0.23070 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1sln |
RMSD bond length | 0.023 |
RMSD bond angle | 1.968 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | ILMLIONE (v3.0) |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 62.600 | 2.050 |
High resolution limit [Å] | 1.830 | 1.920 |
Rmerge | 0.039 | |
Number of reflections | 28549 | |
Completeness [%] | 99.9 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 25-30% PEG 8000, 10 mM CaCl2, 100 mM TRIS , pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |