6LJE
Crystal structure of gelsolin G3 domain (calcium and magnesium condition)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AichiSR BEAMLINE BL2S1 |
Synchrotron site | AichiSR |
Beamline | BL2S1 |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2018-07-19 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.12 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 58.900, 41.240, 84.590 |
Unit cell angles | 90.00, 105.54, 90.00 |
Refinement procedure
Resolution | 40.750 - 1.400 |
R-factor | 0.183 |
Rwork | 0.183 |
R-free | 0.18870 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ffk |
RMSD bond length | 0.012 |
RMSD bond angle | 1.213 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | PHENIX (1.15) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 40.751 | 40.751 | 1.490 |
High resolution limit [Å] | 1.400 | 4.180 | 1.400 |
Rmerge | 0.052 | 0.029 | 0.851 |
Rmeas | 0.058 | 0.032 | 0.956 |
Number of reflections | 37286 | 1522 | 5818 |
<I/σ(I)> | 15.58 | 47.48 | 1.53 |
Completeness [%] | 96.5 | 99.2 | 93.7 |
Redundancy | 5.107 | 5.456 | 4.774 |
CC(1/2) | 0.999 | 0.999 | 0.686 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | PEG3350, ammonium sulphate, calcium chloride, magnesium chloride |