4JLP
Crystal structure of R150K aquifex adenylate kinase mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9999 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 67.010, 70.460, 85.580 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.064 - 1.433 |
R-factor | 0.155 |
Rwork | 0.153 |
R-free | 0.19490 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 1.253 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.7.2_865) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 36.570 | 36.570 | 1.510 |
High resolution limit [Å] | 1.430 | 4.530 | 1.430 |
Rmerge | 0.037 | 0.268 | |
Number of reflections | 75039 | ||
<I/σ(I)> | 17.5 | 32.1 | 4.3 |
Completeness [%] | 99.9 | 99 | 99.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.4 | 295 | 0.1M Sodium Acetate trihydrate pH 5.4, 0.2M Ammonium Acetate, 30% w/v Polyethylene Glycol 4000, VAPOR DIFFUSION, HANGING DROP, temperature 295K |