8BO9
NanoLuc-D9R/H57A/K89R mutant complexed with azacoelenterazine bound in intra-barrel catalytic site
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-10-07 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 147.907, 112.601, 59.703 |
Unit cell angles | 90.00, 90.80, 90.00 |
Refinement procedure
Resolution | 46.771 - 3.100 |
R-factor | 0.2742 |
Rwork | 0.272 |
R-free | 0.30740 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7vsx |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.14-3260-0000) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.490 | 3.310 |
High resolution limit [Å] | 3.100 | 3.100 |
Number of reflections | 17550 | 3209 |
<I/σ(I)> | 6 | |
Completeness [%] | 98.5 | |
Redundancy | 3.5 | |
CC(1/2) | 0.997 | 0.219 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293.15 | PEG 10000, ammonium acetate, Bis-tris |