7KCN
Reconstructed ancestor of HIUases and Transthyretins
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS BEAMLINE W01B-MX2 |
Synchrotron site | LNLS |
Beamline | W01B-MX2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-10-19 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1.459 |
Spacegroup name | P 41 2 2 |
Unit cell lengths | 67.030, 67.030, 116.890 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.100 - 1.460 |
R-factor | 0.1623 |
Rwork | 0.161 |
R-free | 0.18170 |
Structure solution method | SIRAS |
RMSD bond length | 0.015 |
RMSD bond angle | 1.524 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX (1.14_3260) |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.050 | 1.550 |
High resolution limit [Å] | 1.460 | 1.460 |
Rmeas | 0.063 | 0.353 |
Number of reflections | 45814 | 11794 |
<I/σ(I)> | 24.7 | 3.8 |
Completeness [%] | 97.1 | 82.8 |
Redundancy | 11.5 | 5.3 |
CC(1/2) | 0.999 | 0.933 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | 20-24% (w/v) PEG 1,500, 20-30% (v/v) glycerol |