2FMN
Ala177Val mutant of E. coli Methylenetetrahydrofolate Reductase complex with LY309887
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2000-01-01 |
| Detector | RIGAKU RAXIS IV |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 101.560, 128.640, 96.744 |
| Unit cell angles | 90.00, 120.87, 90.00 |
Refinement procedure
| Resolution | 35.780 - 2.050 |
| R-factor | 0.217 |
| Rwork | 0.217 |
| R-free | 0.25000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1b5t |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.500 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.800 | 2.180 |
| High resolution limit [Å] | 2.050 | 2.050 |
| Number of reflections | 62268 | |
| Completeness [%] | 93.3 | 85.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 295 | PEG 8000, MAGNESIUM ACETATE, SODIUM CACODYLATE, GLYCEROL, METHYLPENTANEDIOL, LY309887, VAPOR DIFFUSION, HANGING DROP, temperature 295K, pH 6.50 |
