5N0P
Crystal structure of OphA-DeltaC18 in complex with SAH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-08-01 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9281 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 74.802, 100.216, 124.490 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 78.060 - 2.160 |
| R-factor | 0.20142 |
| Rwork | 0.200 |
| R-free | 0.22628 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5n0o |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.315 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.200 | 2.164 |
| High resolution limit [Å] | 2.157 | 2.157 |
| Rmerge | 0.033 | 0.661 |
| Number of reflections | 51104 | |
| <I/σ(I)> | 20.9 | |
| Completeness [%] | 99.9 | 98.5 |
| Redundancy | 5.5 | 5.8 |
| CC(1/2) | 1.000 | 0.790 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289 | 0.04 M ammonium citrate tribasic, 0.1 M sodium citrate pH 5.5 and 27% PEG MME 5000. |
