3BU3
Crystal structure of the insulin receptor kinase in complex with IRS2 KRLB peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4A |
| Synchrotron site | NSLS |
| Beamline | X4A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-04-04 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.759, 84.932, 50.708 |
| Unit cell angles | 90.00, 113.21, 90.00 |
Refinement procedure
| Resolution | 46.630 - 1.650 |
| R-factor | 0.20281 |
| Rwork | 0.202 |
| R-free | 0.21950 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.278 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.710 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.046 | 0.347 |
| Number of reflections | 41344 | |
| <I/σ(I)> | 22.9 | 2.8 |
| Completeness [%] | 99.6 | 99.5 |
| Redundancy | 3.1 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 277 | 28% PEG8000 0.1 M HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
