3EPN
Crystal structure of Caulobacter crescentus ThiC complexed with imidazole ribonucleotide
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 | 2008-03-28 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97918 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.603, 102.738, 82.635 |
Unit cell angles | 90.00, 102.05, 90.00 |
Refinement procedure
Resolution | 35.240 - 2.110 |
R-factor | 0.172 |
Rwork | 0.168 |
R-free | 0.24900 |
RMSD bond length | 0.006 |
RMSD bond angle | 0.996 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.190 |
High resolution limit [Å] | 2.110 | 4.540 | 2.110 |
Rmerge | 0.164 | 0.085 | 0.317 |
Number of reflections | 52600 | ||
Completeness [%] | 90.1 | 94 | 75.1 |
Redundancy | 2.7 | 3.4 | 1.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 1.4 M sodium citrate, 0.1 M sodium HEPES, pH 7.5, vapor diffusion, hanging drop, temperature 298K |