6F79
Carboxypeptidase T mutant L211Q with Sulphamoil Arginine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-12-04 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.8 |
Spacegroup name | P 63 2 2 |
Unit cell lengths | 157.960, 157.960, 104.850 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 29.850 - 1.900 |
R-factor | 0.12794 |
Rwork | 0.127 |
R-free | 0.14715 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3qnv |
RMSD bond length | 0.009 |
RMSD bond angle | 1.313 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.107 | 0.260 |
Number of reflections | 60927 | 8747 |
<I/σ(I)> | 4.4391 | 2.75 |
Completeness [%] | 100.0 | 100 |
Redundancy | 20.62 | 20.89 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIQUID DIFFUSION | 296 | 1,4 SA |