6U4Z
Crystal Structure of a family 76 glycoside hydrolase from a bovine Bacteroides thetaiotaomicron strain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08B1-1 |
Synchrotron site | CLSI |
Beamline | 08B1-1 |
Temperature [K] | 80 |
Detector technology | CCD |
Collection date | 2018-03-24 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 0.97949 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 55.420, 58.520, 159.080 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.137 - 1.400 |
R-factor | 0.1809 |
Rwork | 0.180 |
R-free | 0.19530 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4c1s |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 47.137 | 47.137 | 1.450 |
High resolution limit [Å] | 1.400 | 5.410 | 1.400 |
Rmerge | 0.059 | 0.033 | 0.546 |
Rmeas | 0.068 | 0.036 | 0.596 |
Total number of observations | 847371 | ||
Number of reflections | 102646 | 1971 | 9970 |
<I/σ(I)> | 16.62 | 32.59 | 3.25 |
Completeness [%] | 100.0 | 99.8 | 99.8 |
Redundancy | 6.9 | 6.616 | 6.309 |
CC(1/2) | 0.999 | 0.997 | 0.846 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 22% (w/v) PEG 1500, 100mM Sodium chloride, and 100mM Bis-TRIS-Propane pH 8.2 |