7L0I
Ligand-free YopH G352T
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 | 2019-02-06 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.97946 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 49.135, 56.296, 98.335 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.170 - 2.020 |
R-factor | 0.2043 |
Rwork | 0.202 |
R-free | 0.25290 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4yaa |
Data reduction software | HKL-3000 |
Data scaling software | HKL-2000 |
Phasing software | HKL-3000 |
Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.100 |
High resolution limit [Å] | 2.020 | 4.370 | 2.030 |
Rmerge | 0.181 | 0.086 | 0.960 |
Rmeas | 0.198 | 0.093 | 1.133 |
Rpim | 0.079 | 0.035 | 0.578 |
Number of reflections | 17704 | 2003 | 1431 |
<I/σ(I)> | 7.8 | ||
Completeness [%] | 95.2 | 99.6 | 79.6 |
Redundancy | 5.5 | 6.5 | 3 |
CC(1/2) | 0.996 | 0.467 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 277 | 0.1 M HEPES pH 7.5, and 15-34 % PEG 3350 |