4DAT
Structure of 14-3-3 sigma in complex with PADI6 14-3-3 binding motif II
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 | 2010-08-22 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 1.040 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 82.220, 112.360, 62.730 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.580 - 1.400 |
| R-factor | 0.1489 |
| Rwork | 0.147 |
| R-free | 0.18320 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.034 |
| RMSD bond angle | 2.249 |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 45.584 | 45.500 | 1.600 |
| High resolution limit [Å] | 1.400 | 20.000 | 1.400 |
| Rmerge | 0.027 | 0.022 | 0.162 |
| Number of reflections | 56629 | 20 | 18214 |
| <I/σ(I)> | 26.79 | 62.79 | 7.05 |
| Completeness [%] | 98.6 | 69 | 97.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 277 | 26.6% v/v PEG400, 0.19 M calcium chloride, 5% v/v glycerol, 0.095 M HEPES sodium, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
