1NWQ
CRYSTAL STRUCTURE OF C/EBPALPHA-DNA COMPLEX
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X9B |
Synchrotron site | NSLS |
Beamline | X9B |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.07 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 140.892, 53.089, 67.406 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.000 * - 2.800 |
R-factor | 0.221 |
Rwork | 0.221 |
R-free | 0.27500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dh3 |
RMSD bond length | 0.019 |
RMSD bond angle | 20.500 * |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.900 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.076 | 0.415 |
Total number of observations | 222356 * | |
Number of reflections | 12416 | |
<I/σ(I)> | 19.2 | 2.7 |
Completeness [%] | 95.6 | 91.6 |
Redundancy | 17.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.7 | 4 * | NACL, MGCL2, PEG 400, MES, GLYCEROL, pH 5.7, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 0.75 (mM) | |
2 | 1 | drop | DNA | 0.5 (mM) | |
3 | 1 | drop | 50 (mM) | ||
4 | 1 | drop | MES | 100 (mM) | pH5.7 |
5 | 1 | reservoir | MES | 100 (mM) | pH5.7 |
6 | 1 | reservoir | 100 (mM) | ||
7 | 1 | reservoir | 30 (mM) | ||
8 | 1 | reservoir | PEG400 | 18 (%) | |
9 | 1 | reservoir | glycerol | 10 (%) |