5CIS
The CUB1-EGF-CUB2 domains of rat MBL-associated serine protease-2 (MASP-2) bound to Ca2+
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-09-23 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.92 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 66.930, 98.300, 121.410 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.343 - 2.580 |
R-factor | 0.2022 |
Rwork | 0.200 |
R-free | 0.24070 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1nto |
RMSD bond length | 0.003 |
RMSD bond angle | 0.712 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.300 | 2.600 |
High resolution limit [Å] | 2.580 | 2.580 |
Rmerge | 0.645 | |
Number of reflections | 12626 | |
<I/σ(I)> | 11.58 | 2.03 |
Completeness [%] | 97.6 | 93.5 |
Redundancy | 3.9 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris pH 8.5 containing 80 mM ammonium acetate |