3BZG
UVDE pH4.4
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-07-16 |
| Detector | MAR225 |
| Wavelength(s) | 0.933 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 107.140, 107.140, 90.830 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 28.780 - 1.910 |
| R-factor | 0.19823 |
| Rwork | 0.196 |
| R-free | 0.24437 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2j6v |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.689 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 92.848 | 2.010 |
| High resolution limit [Å] | 1.910 | 1.910 |
| Rmerge | 0.048 | 0.282 |
| Number of reflections | 24142 | |
| <I/σ(I)> | 10.2 | |
| Completeness [%] | 99.2 | 100 |
| Redundancy | 6.4 | 6.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.4 | 295 | Acetate, Naformate, MnCl2, pH4.4, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
