8QCL
A carbohydrate esterase family 15 (CE15) glucuronoyl esterase from Phocaeicola vulgatus ATCC 8482
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID30B |
Synchrotron site | ESRF |
Beamline | ID30B |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-09-09 |
Detector | DECTRIS EIGER2 X 9M |
Wavelength(s) | 0.9117 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 74.282, 59.525, 87.452 |
Unit cell angles | 90.00, 101.55, 90.00 |
Refinement procedure
Resolution | 48.930 - 1.840 |
R-factor | 0.17528 |
Rwork | 0.172 |
R-free | 0.23580 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.458 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.930 | 1.999 |
High resolution limit [Å] | 1.800 | 1.838 |
Number of reflections | 42976 | 2149 |
<I/σ(I)> | 9 | |
Completeness [%] | 94.8 | |
Redundancy | 4.3 | |
CC(1/2) | 0.996 | 0.575 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M MES pH 6.0, 20 mM NaCl, and 20-24% (w/v) PEG 6000 |