6ZVL
ARUK3000263 complex with Notum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-05-02 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.9159 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 59.805, 71.791, 78.036 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 52.830 - 1.300 |
R-factor | 0.2018 |
Rwork | 0.201 |
R-free | 0.22260 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6tr5 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | MOLREP |
Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 59.800 | 1.320 |
High resolution limit [Å] | 1.300 | 1.300 |
Number of reflections | 83089 | 3974 |
<I/σ(I)> | 14.3 | 1.8 |
Completeness [%] | 99.9 | |
Redundancy | 12.3 | |
CC(1/2) | 0.990 | 0.600 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 4.2 | 293 | 1.5 M Ammonium Sulphate 0.1 M Sodium Citrate, pH 4.2 |