2NS8
How an in vitro selected peptide mimics the antibiotic tetracycline to induce TET repressor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.2 |
Synchrotron site | BESSY |
Beamline | 14.2 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2004-10-13 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 0.918 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 77.890, 200.590, 65.280 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 2.550 |
R-factor | 0.211 |
Rwork | 0.206 |
R-free | 0.27000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2tct |
RMSD bond length | 0.013 |
RMSD bond angle | 1.380 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.710 | |
High resolution limit [Å] | 2.550 | 5.370 | 2.550 |
Rmerge | 0.090 | 0.047 | 0.483 |
Number of reflections | 33932 | ||
<I/σ(I)> | 14.93 | 27.1 | 3.7 |
Completeness [%] | 99.4 | 99.8 | 98.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.8 | 292 | 4M sodium formate, 0.1M Tris-HCl, pH 7.8, VAPOR DIFFUSION, HANGING DROP, temperature 292K |