6MMD
Photoactive Yellow Protein with 3,5-dichlorotyrosine substituted at position 42
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2016-02-22 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97946 |
| Spacegroup name | P 3 |
| Unit cell lengths | 65.909, 65.909, 40.503 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 33.032 - 1.228 |
| R-factor | 0.1547 |
| Rwork | 0.153 |
| R-free | 0.18100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1nwz |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.446 |
| Data reduction software | DENZO |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.270 |
| High resolution limit [Å] | 1.228 | 1.228 |
| Rmerge | 0.070 | |
| Number of reflections | 56619 | |
| <I/σ(I)> | 49.03 | |
| Completeness [%] | 98.5 | |
| Redundancy | 8.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 1M sodium chloride, 2.4M ammonium sulfate, pH = 6.0, drops were microseeded |
