1WWP
Crystal structure of ttk003001694 from Thermus Thermophilus HB8
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B1 |
Synchrotron site | SPring-8 |
Beamline | BL26B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-11-06 |
Detector | RIGAKU JUPITER 210 |
Wavelength(s) | 0.9600, 0.9790, 0.9793 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 74.380, 61.420, 60.780 |
Unit cell angles | 90.00, 122.00, 90.00 |
Refinement procedure
Resolution | 44.010 - 2.110 |
R-factor | 0.217 |
Rwork | 0.217 |
R-free | 0.27000 |
Structure solution method | MAD |
RMSD bond length | 0.009 |
RMSD bond angle | 1.400 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.180 |
High resolution limit [Å] | 2.100 | 2.100 |
Number of reflections | 13063 | |
<I/σ(I)> | 13.5 | 5.9 |
Completeness [%] | 97.5 | 92.4 |
Redundancy | 4.2 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | PEG6000, Lithium Chloride, MES, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |