8H17
Crystal structure of the Globin domain of Thermosynechococcus elongatus BP-1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2022-01-18 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.54178 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 54.041, 54.041, 112.966 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 22.230 - 2.150 |
R-factor | 0.17855 |
Rwork | 0.176 |
R-free | 0.22292 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | Alfa fold |
RMSD bond length | 0.017 |
RMSD bond angle | 1.874 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0352) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.000 | 2.230 |
High resolution limit [Å] | 2.150 | 2.150 |
Number of reflections | 9714 | 932 |
<I/σ(I)> | 65.5 | |
Completeness [%] | 99.7 | |
Redundancy | 23.9 | |
CC(1/2) | 0.990 | 0.900 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 1.5 M Ammonium sulfate, 0.1 M MES 0.02 M Cobalt chloride hexahydrate 10% Glycerol |