3TSW
crystal structure of the PDZ3-SH3-GUK core module of Human ZO-1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-BM |
Synchrotron site | APS |
Beamline | 22-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-11-20 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | P 32 |
Unit cell lengths | 100.634, 100.634, 182.516 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 87.170 - 2.847 |
R-factor | 0.21848 |
Rwork | 0.211 |
R-free | 0.28972 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3lh5 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.565 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 87.170 | 3.000 |
High resolution limit [Å] | 2.830 | 2.830 |
Rmerge | 0.089 | 0.976 |
Number of reflections | 47918 | |
<I/σ(I)> | 17.08 | 1.87 |
Completeness [%] | 97.6 | 86.9 |
Redundancy | 5.6 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293.15 | 1.2M AmSO4, 0.1M NaAc pH 5.0, 60mM NaF, VAPOR DIFFUSION, HANGING DROP, temperature 293.15K |