6WNB
Structure of the Rieske non-heme iron oxygenase SxtT with dideoxysaxitoxin bound
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-06-06 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 1.0 |
Spacegroup name | C 2 2 2 |
Unit cell lengths | 152.276, 159.577, 115.979 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.160 - 2.100 |
R-factor | 0.1704 |
Rwork | 0.168 |
R-free | 0.20750 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6wn3 |
RMSD bond length | 0.008 |
RMSD bond angle | 0.971 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.160 | 2.175 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.087 | 0.436 |
Number of reflections | 81796 | 8066 |
<I/σ(I)> | 15.8 | 2.07 |
Completeness [%] | 98.4 | |
Redundancy | 4.7 | |
CC(1/2) | 0.984 | 0.890 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 2.0 M (NH4)2SO4, 0.1 M Bis-Tris pH 6.5, 10% v/v glycerol |