6KK9
A Crystal structure of OspA mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-5A |
Synchrotron site | Photon Factory |
Beamline | BL-5A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-12-23 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0000 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 102.537, 138.641, 62.514 |
Unit cell angles | 90.00, 100.88, 90.00 |
Refinement procedure
Resolution | 19.900 - 2.200 |
R-factor | 0.225655815502 |
Rwork | 0.222 |
R-free | 0.28685 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3cka |
RMSD bond length | 0.009 |
RMSD bond angle | 1.029 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.068 | 0.470 |
Number of reflections | 43410 | 4307 |
<I/σ(I)> | 30.1 | 3.44 |
Completeness [%] | 99.9 | 99.5 |
Redundancy | 7.2 | 6.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 293 | 30% PEG 400, 0.1 M Tris-HCl |