6ZC6
Small-molecule inhibitors of the PDZ domain of Dishevelled proteins interrupt Wnt signalling
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2009-05-26 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.91841 |
| Spacegroup name | I 4 2 2 |
| Unit cell lengths | 78.608, 78.608, 77.818 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 32.040 - 1.580 |
| R-factor | 0.171 |
| Rwork | 0.170 |
| R-free | 0.19800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2f0a |
| RMSD bond length | 0.001 |
| RMSD bond angle | 0.969 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 32.040 | 1.620 |
| High resolution limit [Å] | 1.580 | 1.580 |
| Rmeas | 0.006 | 0.069 |
| Number of reflections | 16954 | 1229 |
| <I/σ(I)> | 18.1 | 2.9 |
| Completeness [%] | 99.5 | |
| Redundancy | 7.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 1 M ammonium sulphate, 1% PEG 3350, 0.1 M Bis-Tris pH 5.5 |
