7E1F
Native-DBD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-06-11 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97890 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 35.455, 52.135, 96.961 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.318 - 1.447 |
R-factor | 0.1917 |
Rwork | 0.190 |
R-free | 0.21630 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | Se-DBD |
RMSD bond length | 0.005 |
RMSD bond angle | 0.809 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | HKL-3000 |
Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.500 |
High resolution limit [Å] | 1.447 | 1.450 |
Number of reflections | 29399 | 29399 |
<I/σ(I)> | 37.34 | |
Completeness [%] | 97.9 | |
Redundancy | 12.2 | |
CC(1/2) | 0.994 | 0.979 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M NaCl, 0.1 M HEPES pH 7.0, and 20% (W/V) PEG6000 |