4Y5O
CCM2 HHD in complex with MEKK3 NPB1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-07-24 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97914 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 43.310, 45.349, 61.533 |
Unit cell angles | 90.00, 94.95, 90.00 |
Refinement procedure
Resolution | 36.811 - 2.350 |
R-factor | 0.2087 |
Rwork | 0.207 |
R-free | 0.23230 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4fqn 2o2v |
RMSD bond length | 0.007 |
RMSD bond angle | 1.018 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.8.1_1168) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.430 |
High resolution limit [Å] | 2.350 | 5.060 | 2.350 |
Rmerge | 0.115 | 0.062 | 0.688 |
Total number of observations | 57461 | ||
Number of reflections | 10025 | ||
<I/σ(I)> | 11 | ||
Completeness [%] | 97.6 | 95.7 | 98.7 |
Redundancy | 5.7 | 6 | 5.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M potassium phosphate and 20% PEG 3350 |