4L3L
Crystal structures of human p70S6K1 kinase domain (Zinc anomalous)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-05-20 |
| Detector | CCD ADSC unsupported-q315 |
| Wavelength(s) | 1.2826 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 69.408, 69.408, 143.378 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.480 - 2.100 |
| R-factor | 0.2085 |
| Rwork | 0.206 |
| R-free | 0.24670 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3a62 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.236 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.180 |
| High resolution limit [Å] | 2.100 | 4.520 | 2.100 |
| Rmerge | 0.121 | 0.080 | 0.430 |
| Number of reflections | 20480 | ||
| <I/σ(I)> | 12.2 | ||
| Completeness [%] | 96.3 | 84.5 | 100 |
| Redundancy | 8.9 | 7.3 | 9.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 289 | 2.5M sodium formate, 0.1M HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K |
