4TSQ
Crystal structure of FraC with DHPC bound (crystal form III)
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 | 2013-12-16 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.0000 |
Spacegroup name | P 32 |
Unit cell lengths | 70.270, 70.270, 202.973 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.250 - 1.600 |
R-factor | 0.13265 |
Rwork | 0.132 |
R-free | 0.15419 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3vwi |
RMSD bond length | 0.019 |
RMSD bond angle | 2.146 |
Refinement software | REFMAC (5.8.0069) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.250 | 1.690 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.045 | 0.136 |
Number of reflections | 141157 | |
<I/σ(I)> | 17 | 5 |
Completeness [%] | 95.4 | 77.1 |
Redundancy | 3.3 | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2 M sodium thiocyanate, 20% PEG 3350, 30 mM DHPC, 3 mM dehydroepiandrosterone |