4YEE
beta2 carbohydrate binding module (CBM) of AMP-activated protein kinase (AMPK) in complex with glucosyl-beta-cyclodextrin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-06-20 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.953700 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 204.538, 96.432, 118.724 |
Unit cell angles | 90.00, 125.46, 90.00 |
Refinement procedure
Resolution | 43.380 - 2.000 |
R-factor | 0.1715 |
Rwork | 0.169 |
R-free | 0.22463 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2f15 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.680 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.380 | 2.030 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.084 | 0.668 |
Number of reflections | 127116 | |
<I/σ(I)> | 16.9 | 2.8 |
Completeness [%] | 99.9 | 97.8 |
Redundancy | 7.6 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 281.15 | in 0.2 M lithium chloride, 20% w/v PEG 6000 and 0.1 M sodium HEPES pH 7 |