6HUF
Coping with strong translational non-crystallographic symmetry and extreme anisotropy in molecular replacement with Phaser: human Rab27a
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-04-20 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.97949 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 130.420, 132.410, 230.590 |
| Unit cell angles | 90.00, 103.57, 90.00 |
Refinement procedure
| Resolution | 80.150 - 2.820 |
| R-factor | 0.31339 |
| Rwork | 0.312 |
| R-free | 0.34236 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3bc1 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.479 |
| Data reduction software | DIALS |
| Data scaling software | DIALS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 80.150 | 2.880 |
| High resolution limit [Å] | 2.820 | 2.820 |
| Rmerge | 0.081 | 0.991 |
| Rmeas | 0.109 | 1.038 |
| Rpim | 0.073 | 0.691 |
| Number of reflections | 91204 | 4512 |
| <I/σ(I)> | 7.9 | 1 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 3.7 | 5.6 |
| CC(1/2) | 0.995 | 0.688 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 20% (v/v) ethylene glycol, 10% (w/v) PEG 8000, 30 mM MgCl2, 30 mM CaCl2 and 100 mM HEPES pH 7.5 |
