8TRX
Crystal structure of a CE15 glucuronoyl esterase from Piromyces rhizinflatus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2019-02-10 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.00334 |
Spacegroup name | P 61 |
Unit cell lengths | 139.680, 139.680, 125.830 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.745 - 2.540 |
R-factor | 0.2311 |
Rwork | 0.229 |
R-free | 0.26890 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.083 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 46.745 | 46.745 | 2.710 |
High resolution limit [Å] | 2.540 | 5.000 | 2.540 |
Rmerge | 0.081 | 0.039 | 0.820 |
Rmeas | 0.086 | 0.041 | 0.862 |
Number of reflections | 45952 | 6102 | 8061 |
<I/σ(I)> | 19.03 | 45.64 | 2.76 |
Completeness [%] | 100.0 | 99.9 | 100 |
Redundancy | 10.4 | 10.224 | 10.568 |
CC(1/2) | 0.999 | 0.999 | 0.858 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 298 | 20% PEG10000, 100 mM HEPES, pH 7.5 |