3EMD
Wesselsbron virus Methyltransferase in complex with Sinefungin and 7MeGpppA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-11-10 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.933 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 37.057, 61.157, 128.831 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 32.210 - 2.000 |
| R-factor | 0.16457 |
| Rwork | 0.162 |
| R-free | 0.21466 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3elu |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.224 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.370 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.094 | 0.293 |
| Number of reflections | 20462 | |
| <I/σ(I)> | 11.5 | 4.6 |
| Completeness [%] | 99.6 | 99.9 |
| Redundancy | 3.5 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.2 | 293 | 1mM Sinefungin, 1mM 7MeGpppA, 10% PEG 4000, pH 6.2, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
