7SMU
Crystal Structure of Consomatin-Ro1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-07-10 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.77114 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 50.282, 50.282, 135.005 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 36.619 - 1.950 |
Rwork | 0.236 |
R-free | 0.28160 |
Structure solution method | SAD |
RMSD bond length | 0.012 |
RMSD bond angle | 2.245 |
Data reduction software | XDS |
Data scaling software | Aimless (0.7.4) |
Phasing software | SOLVE |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 36.619 | 36.590 | 2.000 |
High resolution limit [Å] | 1.950 | 8.930 | 1.950 |
Rmerge | 0.227 | 0.101 | 7.639 |
Rmeas | 0.228 | 0.102 | 7.676 |
Rpim | 0.019 | 0.009 | 0.744 |
Total number of observations | 13977 | 54212 | |
Number of reflections | 8016 | 123 | 527 |
<I/σ(I)> | 24.3 | 63.1 | 1.4 |
Completeness [%] | 99.9 | 98.8 | 98.2 |
Redundancy | 140.4 | 113.6 | 102.9 |
CC(1/2) | 1.000 | 1.000 | 0.700 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 286 | 1 micro-liter protein in 100 mM NaCl, 25 mM Tris-Cl pH 7.9, 10% glycerol, 1 mM EDTA, 1 mM TCEP mixed with 1 micro-liter 25% PEG 3350, 100 mM Tris-bis pH 5.5, 100 mM MgCl2 at 13C (286 K) |