7BMG
Inhibitor of MDM2-p53 Interaction
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-12-20 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97957 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 71.530, 71.530, 100.430 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 61.950 - 1.830 |
| R-factor | 0.23 |
| Rwork | 0.229 |
| R-free | 0.25100 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.040 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | BUSTER |
| Refinement software | BUSTER (2.11.7) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 61.950 | 1.880 |
| High resolution limit [Å] | 1.830 | 1.830 |
| Rmerge | 0.044 | 0.592 |
| Number of reflections | 14020 | 1007 |
| <I/σ(I)> | 29.3 | |
| Completeness [%] | 100.0 | |
| Redundancy | 10.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 2.2M (NH4)2SO4 |
