7TVG
Crystal Structure of SHOC2 to a resolution of 2.4 Angstrom
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-09-16 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.979110 |
Spacegroup name | P 32 |
Unit cell lengths | 77.567, 77.567, 83.015 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 35.310 - 2.400 |
R-factor | 0.2189 |
Rwork | 0.216 |
R-free | 0.26710 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | XXXX |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.510 | 2.490 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.036 | 1.090 |
Rpim | 0.024 | 0.721 |
Number of reflections | 21840 | 2289 |
<I/σ(I)> | 19.8 | 1.7 |
Completeness [%] | 99.9 | |
Redundancy | 6.2 | |
CC(1/2) | 1.000 | 0.581 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 1.5M ammonium sulfate, 0.1M sodium citrate pH 5.0 |