2GUS
Conformational Transition between Four- and Five-stranded Phenylalanine Zippers Determined by a Local Packing Interaction
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4A |
Synchrotron site | NSLS |
Beamline | X4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-11-21 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9793, 0.9796, 0.9681 |
Spacegroup name | P 4 21 2 |
Unit cell lengths | 37.002, 37.002, 80.949 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 80.850 - 1.750 |
R-factor | 0.24303 |
Rwork | 0.238 |
R-free | 0.28702 |
Structure solution method | MAD |
RMSD bond length | 0.020 |
RMSD bond angle | 1.421 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.850 | 1.810 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmerge | 0.050 | 0.404 |
Number of reflections | 6157 | |
<I/σ(I)> | 17 | 4.4 |
Completeness [%] | 99.1 | 98.3 |
Redundancy | 7.9 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 0.1M Tris-HCl, 10mM nickel chloride, 14% PEG MME2000, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K |