2ZPM
Crystal structure analysis of PDZ domain B
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | Bruker DIP-6040 |
Wavelength(s) | 0.65 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 70.141, 26.867, 42.789 |
Unit cell angles | 90.00, 112.12, 90.00 |
Refinement procedure
Resolution | 20.750 - 0.980 |
R-factor | 0.15135 |
Rwork | 0.150 |
R-free | 0.18043 |
Structure solution method | SAD |
RMSD bond length | 0.023 |
RMSD bond angle | 2.142 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXCD |
Refinement software | REFMAC (5.5.0035) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 21.470 | 1.030 |
High resolution limit [Å] | 0.980 | 0.980 |
Rmerge | 0.044 | 0.446 |
Number of reflections | 42333 | |
<I/σ(I)> | 17.1 | 2.9 |
Completeness [%] | 99.4 | 99 |
Redundancy | 3.7 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | 25% PEG3350, VAPOR DIFFUSION, temperature 293K |