1X1Q
Crystal structure of tryptophan synthase beta chain from Thermus thermophilus HB8
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B1 |
Synchrotron site | SPring-8 |
Beamline | BL26B1 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2004-04-27 |
Detector | RIGAKU RAXIS V |
Wavelength(s) | 0.97920 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 92.187, 109.993, 74.672 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.600 - 2.500 |
R-factor | 0.203 |
Rwork | 0.201 |
R-free | 0.24500 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.300 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.131 | 0.580 |
Number of reflections | 26974 | |
<I/σ(I)> | 7.4 | 3.27 |
Completeness [%] | 99.5 | 99.5 |
Redundancy | 5.1 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 8.5 | 291 | 0.2M Magnesium Chloride, 0.1M Tris-HCl, 15 % w/v PEG 4000, pH 8.5, MICROBATCH, temperature 291K |