4ZSJ
MITOGEN ACTIVATED PROTEIN KINASE 7 IN COMPLEX WITH INHIBITOR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-07-11 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.979 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 93.040, 93.040, 110.610 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 71.200 - 2.480 |
R-factor | 0.1701 |
Rwork | 0.167 |
R-free | 0.23030 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | in-house Erk5/MAPK7 structure |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | BUSTER |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 71.200 | 2.540 |
High resolution limit [Å] | 2.480 | 2.480 |
Rmerge | 0.110 | |
Number of reflections | 17842 | |
<I/σ(I)> | 19.1 | 3.5 |
Completeness [%] | 99.9 | 99.8 |
Redundancy | 10.8 | 11.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.25 | 293 | 4-6 % w/v PEG 6000, 0.1 M MES, 5 mM DTT |