3KZE
Crystal Structure of T-cell Lymphoma Invasion and Metastasis-1 PDZ in Complex With SSRKEYYA Peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-D |
Synchrotron site | APS |
Beamline | 23-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-06-16 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.03320 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 37.780, 54.526, 65.124 |
Unit cell angles | 90.00, 96.26, 90.00 |
Refinement procedure
Resolution | 32.368 - 1.800 |
R-factor | 0.1964 |
Rwork | 0.196 |
R-free | 0.21190 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.907 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | MOLREP |
Refinement software | PHENIX (1.6_289) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.740 | 1.660 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.045 | 0.507 |
Number of reflections | 33563 | |
<I/σ(I)> | 1.5 | |
Completeness [%] | 96.2 | 96.1 |
Redundancy | 2.55 | 2.35 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 288 | 20% (w/v) PEG 3350, 0.2 M Na2SO4, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 288K |