3TH6
Crystal structure of Triosephosphate isomerase from Rhipicephalus (Boophilus) microplus.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 5ID-B |
Synchrotron site | APS |
Beamline | 5ID-B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-10-05 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.97700 |
Spacegroup name | P 65 |
Unit cell lengths | 53.384, 53.384, 278.775 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.460 - 2.400 |
R-factor | 0.221 |
Rwork | 0.186 |
R-free | 0.22800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1wyi |
RMSD bond length | 0.007 |
RMSD bond angle | 1.400 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.2.19) |
Phasing software | PHASER (1.3.2) |
Refinement software | CNS (1.2) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 46.474 | 7.590 | 2.530 |
High resolution limit [Å] | 2.400 | 5.370 | 2.400 |
Rmerge | 0.102 | 0.064 | 0.375 |
Total number of observations | 9051 | 22329 | |
Number of reflections | 17583 | ||
<I/σ(I)> | 17.3 | 8.9 | 2 |
Completeness [%] | 100.0 | 100 | 100 |
Redundancy | 8.5 | 8.8 | 8.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 0.1 M HEPES/Na, 1.4 M Trisodium citrate dihydrate, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |