3VG8
Crystal structure of hypothetical protein TTHB210 from Thermus thermophilus HB8
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B2 |
Synchrotron site | SPring-8 |
Beamline | BL26B2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-09-29 |
Detector | RAYONIX MX-225 |
Wavelength(s) | 0.9789, 0.9, 0.9795 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 154.977, 100.160, 106.366 |
Unit cell angles | 90.00, 131.19, 90.00 |
Refinement procedure
Resolution | 46.110 - 2.200 |
R-factor | 0.201 |
Rwork | 0.201 |
R-free | 0.25200 |
Structure solution method | MAD |
RMSD bond length | 0.009 |
RMSD bond angle | 1.600 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SOLVE |
Refinement software | CNS (1.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | |
High resolution limit [Å] | 2.200 | |
Rmerge | 0.061 | 0.272 |
Number of reflections | 61889 | |
<I/σ(I)> | 40.2 | 5.35 |
Completeness [%] | 99.4 | 97 |
Redundancy | 5.2 | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.8 | 293 | 0.9M K/Na tartrate, 0.1M Tris-HCl, 40mM magnesium chloride, pH 8.8, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
2 | VAPOR DIFFUSION, HANGING DROP | 8.8 | 293 | 0.95M K/Na tartrate, 0.1M Tris-HCl, 45mM magnesium chloride, pH 8.8, VAPOR DIFFUSION, HANGING DROP, temperature 293K |