4JKY
Cobalt between two ADP's in the active site of adenylate kinase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.2 |
Synchrotron site | ALS |
Beamline | 8.2.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.608600 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 67.550, 73.530, 87.470 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 53.463 - 2.373 |
R-factor | 0.2025 |
Rwork | 0.199 |
R-free | 0.26660 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.276 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASES |
Refinement software | PHENIX (1.7.1_743) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 56.280 | 2.500 |
High resolution limit [Å] | 2.370 | 2.370 |
Rmerge | 0.198 | |
Number of reflections | 18108 | |
<I/σ(I)> | 25.6 | |
Completeness [%] | 99.7 | 97.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.4 | 298 | 0.1M Sodium Acetate trihydrate, 0.2M Ammonium Acetate, 30% w/v Polyethylene Glycol 4000, ADP(17.3mM) and CoCl2(41.2mM), pH 5.4, VAPOR DIFFUSION, HANGING DROP, temperature 298K |