6ASC
Mre11 dimer in complex with Endonuclease inhibitor PFM04
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 12.3.1 |
| Synchrotron site | ALS |
| Beamline | 12.3.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-12-02 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.11583 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.053, 112.682, 81.162 |
| Unit cell angles | 90.00, 100.26, 90.00 |
Refinement procedure
| Resolution | 46.038 - 2.150 |
| R-factor | 0.1984 |
| Rwork | 0.197 |
| R-free | 0.23180 |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.789 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.11.1_2580: ???)) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 50.000 |
| High resolution limit [Å] | 2.150 |
| Number of reflections | 43590 |
| <I/σ(I)> | 46.71 |
| Completeness [%] | 94.2 |
| Redundancy | 4.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | We added 5mM PFM04 (dissolved in DMSO) to 10 mg/ml TmMre11. The mother liquor was 10% PEG3350, 20 mM CaCl2, 0.1 M Mes pH 6.5. This was mixed 1:1 with the protein:inhibitor complex and set up as hanging drop vapor diffusion. For cryoprotection, 20% ethylene glycol was added to the mother liquor. |
