1S3G
Crystal structure of adenylate kinase from Bacillus globisporus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 14-ID-B |
| Synchrotron site | APS |
| Beamline | 14-ID-B |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-07-21 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.1271 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 65.288, 65.288, 94.378 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 27.490 - 2.250 |
| R-factor | 0.223 |
| Rwork | 0.223 |
| R-free | 0.28800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1p3j |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.200 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOMORE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.330 |
| High resolution limit [Å] | 2.250 | 2.250 |
| Rmerge | 0.057 | 0.593 |
| Number of reflections | 21054 | |
| <I/σ(I)> | 24.6 | 2.5 |
| Completeness [%] | 99.2 | 99.4 |
| Redundancy | 5.2 | 4.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | small-scale batch method | 7 | 293 | ammonium sulfate, PEG 1000, sodium azide, pH 7.0, small-scale batch method, temperature 293.0K |
