7BJ0
Inhibitor of MDM2-p53 Interaction
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-08-08 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 1.0719 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 96.538, 96.538, 72.984 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 83.600 - 2.000 |
| R-factor | 0.1949 |
| Rwork | 0.194 |
| R-free | 0.21110 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.307 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0222) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 83.600 | 2.050 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.082 | 0.914 |
| Number of reflections | 25478 | 1925 |
| <I/σ(I)> | 9 | |
| Completeness [%] | 95.5 | |
| Redundancy | 6.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 2.2M (NH4)2SO4 |
