4RGV
Crystal structure of the Methanocaldococcus jannaschii G1PDH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-11-26 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.91840 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 49.765, 59.552, 119.825 |
| Unit cell angles | 90.00, 90.39, 90.00 |
Refinement procedure
| Resolution | 46.070 - 2.450 |
| R-factor | 0.1928 |
| Rwork | 0.193 |
| R-free | 0.23074 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ce9 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.526 |
| 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] | 46.070 | 2.560 |
| High resolution limit [Å] | 2.450 | 2.450 |
| Rmerge | 0.551 | |
| Number of reflections | 25920 | |
| <I/σ(I)> | 2 | |
| Completeness [%] | 98.4 | 98.5 |
| Redundancy | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 294 | 30% (v/v) P550MME/P20K, 0.1 M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 294K |
