6DMA
DHD15_closed
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.1 |
| Synchrotron site | ALS |
| Beamline | 8.2.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-10-27 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.999972 |
| Spacegroup name | P 32 |
| Unit cell lengths | 57.615, 57.615, 130.861 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 39.676 - 3.363 |
| R-factor | 0.2962 |
| Rwork | 0.292 |
| R-free | 0.33320 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | Computational design model |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.359 |
| Data reduction software | HKL-2000 (715) |
| Data scaling software | HKL-2000 (715) |
| Phasing software | PHASER |
| Refinement software | PHENIX ((dev_3084: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.000 | 3.410 |
| High resolution limit [Å] | 3.350 | 3.350 |
| Rmerge | 0.131 | 1.745 |
| Rmeas | 0.142 | 1.892 |
| Rpim | 0.053 | 0.721 |
| Number of reflections | 6816 | 338 |
| <I/σ(I)> | 13.82 | 0.88 |
| Completeness [%] | 98.4 | 96 |
| Redundancy | 6.5 | 6.2 |
| CC(1/2) | 0.337 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 290.15 | 0.1M imidazole pH 7.0, 25% (v/v) PEG 550 MME |
