1RE8
Crystal structure of cAMP-dependent protein kinase complexed with balanol analog 2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL7-1 |
Synchrotron site | SSRL |
Beamline | BL7-1 |
Temperature [K] | 96 |
Detector technology | IMAGE PLATE |
Collection date | 1998-01-01 |
Detector | MARRESEARCH |
Wavelength(s) | 1.08 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 51.800, 71.600, 97.700 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.100 |
Rwork | 0.197 |
R-free | 0.25200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1bx6 |
RMSD bond length | 0.010 |
RMSD bond angle | 2.600 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | X-PLOR |
Refinement software | X-PLOR (3.851) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.180 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.086 | 0.280 |
Number of reflections | 20722 | |
Completeness [%] | 95.0 | 0.91 |
Redundancy | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 4 * | MPD, Bicine, Mega-9, pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 277.15K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 4.5 (mg/ml) | |
2 | 1 | drop | BD2 | 0.45 (mM) | |
3 | 1 | drop | MPD | 3 (%) | |
4 | 1 | drop | bicine | 90 (mM) | pH8.0 |
5 | 1 | drop | Mega-9 | 0.1 (%) | |
6 | 1 | reservoir | bicine | 100 (mM) | pH8.0 |
7 | 1 | reservoir | MPD | 15 (%) |