4G9L
Structure of MMP3 complexed with NNGH inhibitor.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID13 |
| Synchrotron site | ESRF |
| Beamline | ID13 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-07-11 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 37.990, 78.840, 106.730 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 28.810 - 1.880 |
| R-factor | 0.21 |
| Rwork | 0.207 |
| R-free | 0.27000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1sln |
| RMSD bond length | 0.022 |
| RMSD bond angle | 1.872 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | ILMILIONE (V3.0) |
| Refinement software | REFMAC (5.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.990 | 1.860 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Rmerge | 0.439 | |
| Number of reflections | 30555 | |
| <I/σ(I)> | 5.8 | |
| Completeness [%] | 96.4 | 98.4 |
| Redundancy | 8.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 293 | 25-30% PEG 8000, 10 mM CaCl2, 100 mM TRIS, pH 7.5, VAPOR DIFFUSION, temperature 293K |
