6F3Q
Crystal structure of S-adenosyl-L-homocysteine hydrolase from Pseudomonas aeruginosa in complex with adenine and Rb+ cation
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-12-02 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.8077 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 170.492, 99.442, 111.714 |
| Unit cell angles | 90.00, 101.93, 90.00 |
Refinement procedure
| Resolution | 48.530 - 1.450 |
| R-factor | 0.09325 |
| Rwork | 0.093 |
| R-free | 0.12443 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6f3p |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.804 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.540 |
| High resolution limit [Å] | 1.450 | 1.450 |
| Rmerge | 0.049 | |
| Number of reflections | 318355 | |
| <I/σ(I)> | 16.6 | |
| Completeness [%] | 98.6 | |
| Redundancy | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 292 | 50 mM RbH2PO4, 20% (w/v) PEG8000, 2 mM 2'-deoxyadenosine |
