3LCC
Structure of a SAM-dependent halide methyltransferase from Arabidopsis thaliana
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-06-12 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.9334 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 54.430, 54.430, 263.500 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 19.980 - 1.800 |
| R-factor | 0.151 |
| Rwork | 0.149 |
| R-free | 0.17700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2gb4 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.285 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.3.9) |
| Phasing software | PHASER (2.1.4) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.137 | 1.900 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.193 | |
| Number of reflections | 22767 | |
| <I/σ(I)> | 7.9 | |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 7.6 | 5.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 298 | 2.0M (NH4)2SO4, 0.1M citrate, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
