5YS7
Crystal structure of an OspA mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-06-11 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 1.00000 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 85.279, 107.988, 36.290 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.100 |
R-factor | 0.1994 |
Rwork | 0.196 |
R-free | 0.25999 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3cka |
RMSD bond length | 0.011 |
RMSD bond angle | 1.539 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0123) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.140 |
High resolution limit [Å] | 2.100 | 2.100 |
Number of reflections | 20560 | 1032 |
<I/σ(I)> | 29.9 | 4.3 |
Completeness [%] | 99.8 | 99.7 |
Redundancy | 10.3 | 9.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9 | 292 | 0.1 M Tris-HCl, 30% PEG 400 |