8Q1V
TtX183A - A c-type cytochrome domain from the Teredinibacter turnerae protein TERTU_2913
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-1 |
Synchrotron site | ESRF |
Beamline | MASSIF-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-11-29 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.966 |
Spacegroup name | P 41 3 2 |
Unit cell lengths | 92.669, 92.669, 92.669 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 65.530 - 1.400 |
Rwork | 0.165 |
R-free | 0.19300 |
Structure solution method | SAD |
RMSD bond length | 0.017 |
RMSD bond angle | 2.543 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | SHELX |
Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 65.530 | 65.530 | 1.420 |
High resolution limit [Å] | 1.400 | 7.670 | 1.400 |
Rmerge | 0.125 | 0.036 | 3.874 |
Rmeas | 0.129 | 0.037 | 3.976 |
Rpim | 0.029 | 0.008 | 0.894 |
Number of reflections | 27430 | 232 | 1326 |
<I/σ(I)> | 22.5 | ||
Completeness [%] | 100.0 | ||
Redundancy | 36.9 | 30.6 | 37.5 |
CC(1/2) | 1.000 | 1.000 | 0.629 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291 | 20-25 % (w/v) PEG 6000, 1 M LiCl2 and 0.1 M Citrate pH 4.0 |