4RAV
Crystal structure of scFvC4 in complex with the first 17 AA of huntingtin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-06-19 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 1.07169 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 151.313, 35.933, 110.946 |
| Unit cell angles | 90.00, 120.72, 90.00 |
Refinement procedure
| Resolution | 44.236 - 2.500 |
| R-factor | 0.182 |
| Rwork | 0.180 |
| R-free | 0.22630 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.718 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 47.690 | 47.690 | 2.640 |
| High resolution limit [Å] | 2.500 | 7.910 | 2.500 |
| Rmerge | 0.067 | ||
| Number of reflections | 18107 | ||
| <I/σ(I)> | 14.5 | ||
| Completeness [%] | 99.1 | 98.4 | 97.8 |
| Redundancy | 4.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 291 | 0.2 M ammonium sulphate, 25% PEG 4000 and 0.1 M sodium acetate buffer at pH 4.6, VAPOR DIFFUSION, SITTING DROP, temperature 291K |
