3DD9
Structure of DocH66Y dimer
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X13 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X13 |
Temperature [K] | 298 |
Detector technology | CCD |
Collection date | 2007-10-25 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.8081 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 53.084, 197.988, 54.109 |
Unit cell angles | 90.00, 93.04, 90.00 |
Refinement procedure
Resolution | 14.986 - 2.450 |
R-factor | 0.2132 |
Rwork | 0.211 |
R-free | 0.24540 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3dd7 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.565 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 15.000 | 2.510 |
High resolution limit [Å] | 2.450 | 2.450 |
Rmerge | 0.100 | 0.680 |
Number of reflections | 40809 | |
<I/σ(I)> | 7.7 | 2.2 |
Redundancy | 3.8 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 20% PEG10000, 0.1M TRIS, pH8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |