5UMM
CRYSTAL STRUCTURE OF HUMAN MDM2 IN COMPLEX WITH 12-MER PEPTIDE INHIBITOR M3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-11-27 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 26.567, 87.895, 36.576 |
| Unit cell angles | 90.00, 92.30, 90.00 |
Refinement procedure
| Resolution | 43.950 - 1.650 |
| R-factor | 0.18052 |
| Rwork | 0.178 |
| R-free | 0.23112 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3iwy |
| RMSD bond length | 0.027 |
| RMSD bond angle | 2.379 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 43.950 |
| High resolution limit [Å] | 1.650 |
| Rpim | 0.866 |
| Number of reflections | 19635 |
| <I/σ(I)> | 1.09 |
| Completeness [%] | 96.4 |
| Redundancy | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 298 | 0.1 M sodium cacodylate pH 5.5, 25% PEG (w/v) 4000 |
