3D54
Structure of PurLQS from Thermotoga maritima
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-04-10 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9795 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 256.851, 187.337, 159.177 |
Unit cell angles | 90.00, 99.12, 90.00 |
Refinement procedure
Resolution | 45.700 - 3.500 |
R-factor | 0.252 |
Rwork | 0.252 |
R-free | 0.28200 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.013 |
RMSD bond angle | 1.700 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | CNS (1.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.700 | 3.720 |
High resolution limit [Å] | 3.500 | 3.500 |
Number of reflections | 78498 | |
Completeness [%] | 83.8 | 66.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 55% MPD, 0.1M HEPES, 7% xylitol, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |