4RFL
Crystal structure of G1PDH with NADPH from Methanocaldococcus jannaschii
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-06-27 |
| Detector | ADSC QUANTUM 210r |
| Spacegroup name | P 1 |
| Unit cell lengths | 59.391, 72.115, 101.714 |
| Unit cell angles | 77.62, 79.58, 75.63 |
Refinement procedure
| Resolution | 46.680 - 2.200 |
| R-factor | 0.185 |
| Rwork | 0.185 |
| R-free | 0.22500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ce9 |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.577 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.680 | 2.250 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.827 | |
| Number of reflections | 78703 | |
| <I/σ(I)> | 1.9 | |
| Completeness [%] | 98.3 | 95.8 |
| Redundancy | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | 294 | 30% (v/v) P550MME/P20K, 0.1 M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 294K |
