2YWR
Crystal structure of GAR transformylase from Aquifex aeolicus
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B1 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-12-08 |
| Detector | RIGAKU JUPITER 210 |
| Wavelength(s) | 0.9789, 0.9000, 0.9794 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 59.955, 59.955, 105.934 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 42.400 - 1.770 |
| R-factor | 0.204 |
| Rwork | 0.204 |
| R-free | 0.21900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1jkx |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.500 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.880 |
| High resolution limit [Å] | 1.770 | 1.770 |
| Rmerge | 0.073 | 0.277 |
| Number of reflections | 19518 | |
| Completeness [%] | 99.1 | 96 |
| Redundancy | 3.6 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 0.005M Cobalt Chloride hexahydrate, 0.005M Nickel(II) Chloride hexahydrate, 0.005M Cadmium Chloride hexahydrate, 0.005M Magnesium Chloride hexahydrate, 0.1M HEPES, 12% w/v Polyethylene Glycol 3350, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
