5EWZ
Small-molecule stabilization of the 14-3-3/Gab2 PPI interface
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-02-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 73.660, 104.920, 116.030 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.570 - 2.340 |
| R-factor | 0.1964 |
| Rwork | 0.194 |
| R-free | 0.24410 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.024 |
| RMSD bond angle | 1.941 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER (2.3.0) |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 45.570 | 2.350 | |
| High resolution limit [Å] | 2.340 | 12.000 | 2.340 |
| Rmerge | 0.087 | 0.032 | 0.630 |
| Rmeas | 0.097 | 0.035 | 0.695 |
| Total number of observations | 195814 | ||
| Number of reflections | 38368 | 309 | 476 |
| <I/σ(I)> | 13.93 | 35.52 | 3.17 |
| Completeness [%] | 99.1 | 87.3 | 100 |
| Redundancy | 5.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277.15 | 1.2 M sodium hydrogen phosphate, 0.8 M dipotassium hydrogen phosphate, 0.2 M lithium sulfate, 0.1 M CAPS |
