7E4N
Crystal structure of Sat1646
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-11-15 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97915 |
Spacegroup name | P 42 21 2 |
Unit cell lengths | 89.017, 89.017, 68.674 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.610 - 1.940 |
R-factor | 0.1979 |
Rwork | 0.195 |
R-free | 0.24730 |
Structure solution method | SAD |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | AutoSol |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 62.950 | 1.990 |
High resolution limit [Å] | 1.940 | 1.940 |
Rmerge | 0.111 | 1.625 |
Number of reflections | 18106 | 905 |
<I/σ(I)> | 18 | |
Completeness [%] | 87.0 | |
Redundancy | 21.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289 | 15% v/v Tacsimate TM pH 7.0, 0.1M HEPES pH 7.0, 2% w/v Polyethylene glycol 3350 |