5WQF
Structure of fungal meroterpenoid isomerase Trt14
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-06-10 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 100.610, 47.660, 121.440 |
Unit cell angles | 90.00, 108.07, 90.00 |
Refinement procedure
Resolution | 47.824 - 2.001 |
R-factor | 0.2155 |
Rwork | 0.214 |
R-free | 0.24660 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | Selenomethionine labeled Trt14 |
RMSD bond length | 0.007 |
RMSD bond angle | 0.787 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.120 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.048 | |
Number of reflections | 73543 | |
<I/σ(I)> | 14.2 | 2.57 |
Completeness [%] | 98.4 | 97.9 |
Redundancy | 3.42 | 3.4 |
CC(1/2) | 0.920 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 100mM Imidazole (pH 8.0), 10% PEG 8000, 100mM Ca(OAc)2, 2% 1-propanol |