5WTS
Green fluorescent protein linked MTide-02 inhibitor in complex with mdm2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL13B1 |
| Synchrotron site | NSRRC |
| Beamline | BL13B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-05-21 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 51.766, 98.422, 218.988 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.007 - 3.004 |
| R-factor | 0.2061 |
| Rwork | 0.204 |
| R-free | 0.24420 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.473 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.007 | 3.050 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.088 | 0.401 |
| Number of reflections | 11255 | |
| <I/σ(I)> | 14.25 | 2.21 |
| Completeness [%] | 97.3 | 92.6 |
| Redundancy | 4.7 | 4.2 |
| CC(1/2) | 0.887 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 288 | 0.2M sodium chloride, 0.1M Bis-Tris, 25% PEG3350 |
