5X6I
Crystal structure of B. subtilis adenylate kinase variant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-1A |
| Synchrotron site | Photon Factory |
| Beamline | BL-1A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-03-07 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.96400 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 43.739, 44.180, 100.595 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.000 |
| R-factor | 0.18303 |
| Rwork | 0.179 |
| R-free | 0.25881 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1p3j |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.874 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.030 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.580 | |
| Number of reflections | 13718 | |
| <I/σ(I)> | 29.08 | |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 4.7 | 4.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 40mM chloride, 36% polyethylene glycol 1500, 50mM CHES pH 9.0 |
