1ZCE
X-Ray Crystal Structure of Protein Atu2648 from Agrobacterium tumefaciens. Northeast Structural Genomics Consortium Target AtR33.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4A |
Synchrotron site | NSLS |
Beamline | X4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-03-07 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.97914 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 40.642, 42.791, 43.684 |
Unit cell angles | 90.00, 113.67, 90.00 |
Refinement procedure
Resolution | 27.180 - 1.300 |
R-factor | 0.195 |
Rwork | 0.195 |
R-free | 0.21100 |
Structure solution method | SAD |
RMSD bond length | 0.004 |
RMSD bond angle | 1.300 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.350 |
High resolution limit [Å] | 1.300 | 1.300 |
Rmerge | 0.058 | 0.107 |
Number of reflections | 63550 | |
<I/σ(I)> | 16.75 | 7.53 |
Completeness [%] | 95.6 | 98.8 |
Redundancy | 4.1 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 100 mM MES (pH 6), 40% PEG 20K, 100 mM magnesium acetate, 5 mM DTT, VAPOR DIFFUSION, SITTING DROP, temperature 293K |