4MG4
Crystal structure of a putative phosphonomutase from Burkholderia cenocepacia J2315
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-07-02 |
| Detector | RAYONIX MX-300 |
| Wavelength(s) | 0.9798 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 218.600, 91.180, 110.010 |
| Unit cell angles | 90.00, 91.53, 90.00 |
Refinement procedure
| Resolution | 46.290 - 1.700 |
| R-factor | 0.15911 |
| Rwork | 0.158 |
| R-free | 0.18912 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2ze3 |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.621 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.740 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.055 | 0.439 |
| Number of reflections | 236354 | |
| <I/σ(I)> | 17.15 | 3.51 |
| Completeness [%] | 99.8 | 99.9 |
| Redundancy | 3.76 | 3.78 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4 | 289 | JCSG+c2: 20% PEG6000, 1M LiCl, 0.1M NaCit pH4.0, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
