4JT2
Structure of Clostridium thermocellum polynucleotide kinase bound to CTP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 130 |
Detector technology | PIXEL |
Collection date | 2012-09-26 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 45.306, 66.781, 119.546 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.538 - 2.490 |
R-factor | 0.1846 |
Rwork | 0.181 |
R-free | 0.22650 |
Structure solution method | Direct refinement |
RMSD bond length | 0.006 |
RMSD bond angle | 1.093 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.8.1_1168)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 58.000 | 58.000 | 2.580 |
High resolution limit [Å] | 2.480 | 2.580 | 2.480 |
Number of reflections | 13156 | ||
Completeness [%] | 100.0 | 100 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 298 | 100mM sodium citrate, 100mM MgCl2, 16-18% PEG 3350, 2mM CTP, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K |