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 |