4CKQ
X-ray structure of glucuronoxylan-xylanohydrolase (Xyn30A) from Clostridium thermocellum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 315r |
Spacegroup name | P 1 |
Unit cell lengths | 46.090, 47.463, 53.620 |
Unit cell angles | 83.15, 73.41, 65.87 |
Refinement procedure
Resolution | 51.390 - 1.400 |
R-factor | 0.14958 |
Rwork | 0.148 |
R-free | 0.17150 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3gtn |
RMSD bond length | 0.020 |
RMSD bond angle | 1.837 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0071) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.930 | 1.480 |
High resolution limit [Å] | 1.400 | 1.400 |
Rmerge | 0.200 | 0.860 |
Number of reflections | 76088 | |
<I/σ(I)> | 3.5 | 1.3 |
Completeness [%] | 97.2 | 95.6 |
Redundancy | 4.6 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.2 M POTASSIUM SULFATE 20 % (W/V) POLYETHYLENE GLYCOL 3350 |