8TNV
Hemocyanin Functional Unit CCHB-g of Concholepas concholepas
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS SIRIUS BEAMLINE MANACA |
Synchrotron site | LNLS SIRIUS |
Beamline | MANACA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-12-08 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.9772 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 75.682, 103.368, 119.048 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.410 - 1.500 |
R-factor | 0.169 |
Rwork | 0.166 |
R-free | 0.18600 |
Structure solution method | SAD |
RMSD bond length | 0.011 |
RMSD bond angle | 1.076 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | SHELXDE |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.410 | 1.554 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.123 | 1.411 |
Rmeas | 0.128 | 1.466 |
Rpim | 0.035 | 0.393 |
Number of reflections | 149523 | 14807 |
<I/σ(I)> | 14.47 | 2.24 |
Completeness [%] | 99.9 | 99.99 |
Redundancy | 13.2 | 13.8 |
CC(1/2) | 0.999 | 0.762 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 292 | Protein condition: Protein 3 mg/mL, 20 mM Imidazole-HCl pH 6.0, and 300 mM NaCl. Reservoir condition: 20% w/V PEGMME 2000 and 150 mM KBr. |