6CUV
Engineered Holo TrpB from Pyrococcus furiosus, PfTrpB7E6
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-11-18 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.19499 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 83.577, 108.567, 159.331 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.000 - 2.260 |
R-factor | 0.2125 |
Rwork | 0.210 |
R-free | 0.25900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5vm5 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.214 |
Data reduction software | XDS |
Data scaling software | Aimless (0.5.32) |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.310 |
High resolution limit [Å] | 2.260 | 2.260 |
Rmerge | 0.133 | |
Rmeas | 0.146 | |
Rpim | 0.058 | 0.719 |
Number of reflections | 68611 | 4547 |
<I/σ(I)> | 8.9 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 6.2 | 6.2 |
CC(1/2) | 0.990 | 0.655 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.85 | 293 | 14% PEG3350 |