3QNG
Crystal Structure Analysis of Lysozyme-bound fac-[Re(CO)3(L-serine)]
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-06-02 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 78.343, 78.343, 36.546 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.120 - 1.550 |
| R-factor | 0.185 |
| R-free | 0.21700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1iee |
| RMSD bond length | 0.013 |
| RMSD bond angle | 0.031 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.120 | 1.640 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.505 | |
| Number of reflections | 26906 | |
| <I/σ(I)> | 23.76 | 3.65 |
| Completeness [%] | 99.3 | 97.3 |
| Redundancy | 7.75 | 6.85 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.54 | 298 | 0.05M Acetate buffer, 0.9M NaCl, pH 4.54, temperature 298K, VAPOR DIFFUSION, HANGING DROP |
