4WH9
Structure of the CDC25B Phosphatase Catalytic Domain with Bound Inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-F |
Synchrotron site | APS |
Beamline | 21-ID-F |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-06-02 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.97872 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 51.660, 71.470, 73.940 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 51.390 - 1.500 |
R-factor | 0.1273 |
Rwork | 0.126 |
R-free | 0.15201 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2a2k |
RMSD bond length | 0.012 |
RMSD bond angle | 1.928 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 51.390 | 1.400 |
High resolution limit [Å] | 1.330 | 1.330 |
Rmerge | 0.098 | 0.460 |
Number of reflections | 63905 | |
<I/σ(I)> | 10.5 | 1.3 |
Completeness [%] | 100.0 | 100 |
Redundancy | 3.6 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | (NH4)2SO4, Tris, TCEP |