3H9O
Phosphoinositide-dependent protein kinase 1 (PDK-1) in complex with compound 9
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 93 |
| Detector technology | CCD |
| Detector | BRUKER SMART 6000 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 123.770, 123.770, 47.116 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 28.469 - 2.300 |
| R-factor | 0.2112 |
| Rwork | 0.209 |
| R-free | 0.25580 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Data reduction software | SAINT |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 107.200 |
| High resolution limit [Å] | 2.300 |
| Number of reflections | 18783 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | VAPOR DIFFUSION, HANGING DROP |
