6I6M
Papaver somniferum O-methyltransferase 1
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 | 2015-11-28 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.92819 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 68.868, 76.617, 77.158 |
| Unit cell angles | 90.00, 101.55, 90.00 |
Refinement procedure
| Resolution | 75.710 - 1.200 |
| R-factor | 0.11737 |
| Rwork | 0.117 |
| R-free | 0.13021 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6i5q |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.942 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 76.620 | 1.220 |
| High resolution limit [Å] | 1.200 | 1.200 |
| Rmerge | 0.069 | 0.694 |
| Rpim | 0.046 | 0.580 |
| Number of reflections | 237667 | 10664 |
| <I/σ(I)> | 7.2 | 1.2 |
| Completeness [%] | 97.3 | 88.7 |
| Redundancy | 3.1 | 2 |
| CC(1/2) | 0.995 | 0.532 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | PEG 3350, diammonium citrate |
