5K7Y
Crystal structure of enzyme in purine metabolism
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 | 2014-12-19 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.918409 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 91.519, 126.541, 130.320 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.330 - 1.790 |
| R-factor | 0.1717 |
| Rwork | 0.171 |
| R-free | 0.19240 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2j2c |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.472 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP (11.1.03) |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.948 | 1.747 |
| High resolution limit [Å] | 1.738 | 1.738 |
| Rmeas | 0.053 | 0.707 |
| Number of reflections | 76477 | |
| <I/σ(I)> | 20.1 | 1.9 |
| Completeness [%] | 98.2 | 89.6 |
| Redundancy | 5.2 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | 100 mM MES/imidazol containing 200 mM NaCl, 30 % glycerol and 10 % PEG 4000 |
