4H39
Crystal Structure of JNK3 in Complex with JIP1 Peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL11-1 |
Synchrotron site | SSRL |
Beamline | BL11-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-01-17 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.17 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 63.206, 83.711, 83.917 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.510 - 1.992 |
R-factor | 0.2113 |
Rwork | 0.209 |
R-free | 0.23870 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1jnk |
RMSD bond length | 0.003 |
RMSD bond angle | 0.720 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX (1.7.1_743) |
Refinement software | PHENIX ((phenix.refine: 1.7.1_743)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 37.510 | 37.520 | 2.090 |
High resolution limit [Å] | 1.992 | 4.910 | 1.992 |
Number of reflections | 29642 | ||
<I/σ(I)> | 49.3 | ||
Completeness [%] | 95.3 | 98.9 | 81.9 |
Redundancy | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 5.5 | 294 | 0.2 M sodium chloride, 0.1 M Bis-Tris, 28-31% PEG3350, pH 5.5, VAPOR DIFFUSION, temperature 294K |