3THS
Crystal structure of rat native liver Glycine N-methyltransferase complexed with 5-methyltetrahydrofolate pentaglutamate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-BM |
| Synchrotron site | APS |
| Beamline | 22-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-04-15 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 193.036, 61.047, 146.352 |
| Unit cell angles | 90.00, 128.92, 90.00 |
Refinement procedure
| Resolution | 48.220 - 2.500 |
| R-factor | 0.23035 |
| Rwork | 0.228 |
| R-free | 0.27981 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2idk |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.551 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | AMoRE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.220 | 2.565 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Number of reflections | 46441 | |
| <I/σ(I)> | 34.1 | 3 |
| Completeness [%] | 99.7 | 98.5 |
| Redundancy | 7.4 | 7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 295 | 20% PEG 3350, 0.2 M Na-fluoride or Ca-acetate, 100 mM Tris-HCl, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
