4H7M
The X-ray Crystal Structure of the Trichoderma harzianum Endoglucanase 3 from family GH12
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS BEAMLINE W01B-MX2 |
Synchrotron site | LNLS |
Beamline | W01B-MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-07-05 |
Detector | MARRESEARCH |
Wavelength(s) | 1.46 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 47.542, 55.569, 157.261 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.508 - 2.068 |
R-factor | 0.1847 |
Rwork | 0.182 |
R-free | 0.22380 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.039 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER (2.1.4) |
Refinement software | PHENIX (1.6.4_486) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.140 |
High resolution limit [Å] | 2.070 | 4.460 | 2.070 |
Rmerge | 0.113 | 0.070 | 0.199 |
Number of reflections | 26039 | ||
<I/σ(I)> | 23.7 | ||
Completeness [%] | 99.1 | 99.9 | 97.5 |
Redundancy | 6.6 | 6.7 | 6.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 2.0 M Sodium chloride, 12 %(w/v) PEG 6000, vapor diffusion, sitting drop, temperature 291K |