3KCP
Crystal structure of interacting Clostridium thermocellum multimodular components
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE F1 |
Synchrotron site | CHESS |
Beamline | F1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-07-26 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.9179 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 169.977, 58.019, 56.150 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.490 - 1.940 |
R-factor | 0.20567 |
Rwork | 0.206 |
R-free | 0.23109 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.019 |
RMSD bond angle | 1.679 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.490 | 2.050 |
High resolution limit [Å] | 1.940 | 1.940 |
Rmerge | 0.066 | 0.424 |
Number of reflections | 41456 | |
<I/σ(I)> | 9.6 | 3.2 |
Completeness [%] | 98.7 | 98.7 |
Redundancy | 6.8 | 5.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 294 | 100 mM MES, 200 mM Ammonium sulfate, 30% w/v PEG 3350, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 294K |