3JU6
Crystal Structure of Dimeric Arginine Kinase in Complex with AMPPNP and Arginine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4C |
| Synchrotron site | NSLS |
| Beamline | X4C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-08-14 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.9786 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 86.823, 60.073, 139.946 |
| Unit cell angles | 90.00, 93.08, 90.00 |
Refinement procedure
| Resolution | 47.010 - 2.450 |
| R-factor | 0.223 |
| Rwork | 0.214 |
| R-free | 0.25400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ju5 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.540 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.520 |
| High resolution limit [Å] | 2.450 | 2.450 |
| Rmerge | 0.071 | 0.112 |
| Number of reflections | 52310 | |
| <I/σ(I)> | 22.8 | 14.3 |
| Completeness [%] | 97.5 | 89.7 |
| Redundancy | 5.7 | 4.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.6 | 0.1M Bis-Tris (pH 6.6), 12% PEG 1000, VAPOR DIFFUSION, HANGING DROP |
