3A60
Crystal structure of unphosphorylated p70S6K1 (Form I)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-03-19 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 78.600, 62.893, 86.992 |
Unit cell angles | 90.00, 94.32, 90.00 |
Refinement procedure
Resolution | 19.810 - 2.800 |
R-factor | 0.21 |
Rwork | 0.210 |
R-free | 0.26800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | p70S6K1 homology model based on the published RSK1 structure; PDB ENTRY 2Z7R |
RMSD bond length | 0.009 |
RMSD bond angle | 1.500 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | AMoRE |
Refinement software | CNX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.810 | 2.900 |
High resolution limit [Å] | 2.800 | 2.800 |
Number of reflections | 20565 | |
<I/σ(I)> | 14.3 | 2.85 |
Completeness [%] | 97.9 | 83.8 |
Redundancy | 3.6 | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | 0.1M Bis-Tris, pH 5.5, 0.2M lithium sulfate, 22.5% PEG 3350, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |