2QAJ
Crystal structure of a thermostable mutant of Bacillus subtilis Adenylate Kinase (Q199R/G213E)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-05-11 |
Detector | RIGAKU RAXIS |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 34.670, 75.450, 77.570 |
Unit cell angles | 90.00, 98.93, 90.00 |
Refinement procedure
Resolution | 25.000 - 1.800 |
Rwork | 0.227 |
R-free | 0.27300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2eu8 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.250 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.600 | 1.860 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.057 | 0.283 |
Number of reflections | 34668 | |
<I/σ(I)> | 12 | 3.2 |
Completeness [%] | 94.7 | 93.9 |
Redundancy | 2.43 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9 | 293 | CHESS, PEG 1500, CaCl2, pH 9.0, vapor diffusion, hanging drop, temperature 293K |