8YGY
Structure of the KLK1 from Biortus.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-02-25 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 1.180820 |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 45.708, 68.590, 80.458 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.750 - 2.401 |
Rwork | 0.180 |
R-free | 0.24510 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.002 |
RMSD bond angle | 0.996 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.750 | 2.490 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.167 | 0.981 |
Number of reflections | 9127 | 513 |
<I/σ(I)> | 13.9 | |
Completeness [%] | 88.1 | |
Redundancy | 11.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2M (NH4)2SO4, 0.1M Bis-Tris pH6.5, 25% PEG3,350. |