3MHR
14-3-3 sigma in complex with YAP pS127-peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-12-09 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.85 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 82.270, 112.110, 62.850 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.620 - 1.150 |
R-factor | 0.12779 |
Rwork | 0.127 |
R-free | 0.15298 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3lw1 |
RMSD bond length | 0.022 |
RMSD bond angle | 2.055 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.620 | 1.200 |
High resolution limit [Å] | 1.150 | 1.150 |
Rmerge | 0.080 | 0.351 |
Number of reflections | 102833 | |
<I/σ(I)> | 16.54 | 5.23 |
Completeness [%] | 99.8 | 99.9 |
Redundancy | 5.31 | 4.95 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 277 | 0.095M HEPES Na-Salt pH7.4, 25.6% PEG 400, 0.19M CaCl2, 5% Glycerol, VAPOR DIFFUSION, HANGING DROP, temperature 277K |