5N0X
Crystal structure of OphA-DeltaC6 in complex with SAM
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 | 2016-09-25 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9281 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 72.740, 101.960, 121.266 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 78.040 - 1.670 |
| R-factor | 0.1973 |
| Rwork | 0.196 |
| R-free | 0.22429 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5n0o |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.344 |
| 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] | 78.040 | 1.700 |
| High resolution limit [Å] | 1.670 | 1.670 |
| Rmerge | 0.045 | 0.948 |
| Number of reflections | 104957 | |
| <I/σ(I)> | 12.3 | 1.3 |
| Completeness [%] | 99.8 | 98.2 |
| Redundancy | 4.3 | 4.4 |
| CC(1/2) | 0.998 | 0.636 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.02 % octyl beta-D-glucopyranoside (OG), 0.2 M KCl, 0.1 M Bis-Tris pH 6.5 and 20% PEG 4000 |
