9WJ8
N-methyltransferase 1 complexed with SAH and NCM in Chimonanthus praecox
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL10U2 |
| Synchrotron site | SSRF |
| Beamline | BL10U2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2025-04-18 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 1 |
| Unit cell lengths | 50.326, 88.841, 92.272 |
| Unit cell angles | 75.88, 89.97, 76.28 |
Refinement procedure
| Resolution | 20.880 - 2.000 |
| R-factor | 0.2098 |
| Rwork | 0.208 |
| R-free | 0.24160 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.539 |
| Data reduction software | autoPROC |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 83.650 | 1.910 |
| High resolution limit [Å] | 1.810 | 1.810 |
| Number of reflections | 133909 | 19265 |
| <I/σ(I)> | 3.9 | |
| Completeness [%] | 97.7 | |
| Redundancy | 3.2 | |
| CC(1/2) | 0.983 | 0.481 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.2 M Ammonium tartrate dibasic pH7.0, 16% w/v PEG 3350 |
