4TYP
Crystal structure of an adenylate kinase mutant--AKm1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 7A (6B, 6C1) |
Synchrotron site | PAL/PLS |
Beamline | 7A (6B, 6C1) |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-04-20 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.97934 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 43.641, 123.338, 86.693 |
Unit cell angles | 90.00, 98.28, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.900 |
R-factor | 0.28977 |
Rwork | 0.288 |
R-free | 0.32879 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4mkg |
RMSD bond length | 0.010 |
RMSD bond angle | 1.303 |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.000 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.164 | 0.611 |
Number of reflections | 18989 | |
<I/σ(I)> | 5.9 | 2.3 |
Completeness [%] | 94.0 | 94.1 |
Redundancy | 3.5 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | 18% (w/v) polyethylene glycol 3350, 100mM lithium sulfate, 100mM Bis-Tris pH 5.5 |