6BAB
The structure of human CamKII with bound inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-02-21 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 1.08 |
Spacegroup name | P 1 |
Unit cell lengths | 54.250, 67.570, 82.840 |
Unit cell angles | 93.34, 92.93, 90.11 |
Refinement procedure
Resolution | 54.180 - 1.910 |
R-factor | 0.191 |
Rwork | 0.190 |
R-free | 0.25300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.825 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | AMoRE |
Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 54.200 |
High resolution limit [Å] | 1.910 |
Number of reflections | 80037 |
<I/σ(I)> | 7.6 |
Completeness [%] | 87.4 |
Redundancy | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | Sitting drop vapor diffusion droplets were assembled with 250 nL of 12 mg/mL CamKII, 0.6 mM inhibitor and 250 nL of reservoir solution 24% peg 3350, 0.2 M ammonium tartrate, 0.1 M arginine. |