5V3H
Crystal structure of SMYD2 with SAM and EPZ033294
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17B1 |
| Synchrotron site | SSRF |
| Beamline | BL17B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-09-06 |
| Detector | RAYONIX MX300-HS |
| Wavelength(s) | 0.95369 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 157.560, 54.775, 79.702 |
| Unit cell angles | 90.00, 114.22, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.690 |
| R-factor | 0.2202 |
| Rwork | 0.217 |
| R-free | 0.27000 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.345 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.740 |
| High resolution limit [Å] | 2.690 | 2.690 |
| Rmerge | 0.588 | |
| Number of reflections | 17477 | 881 |
| <I/σ(I)> | 14.6 | 2.35 |
| Completeness [%] | 98.8 | 100 |
| Redundancy | 3.7 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 5% v/v Ethanol, 0.1 M Tris pH 7.5, 26% w/v PEG3350 |
