5MFJ
Designed armadillo repeat protein YIII(Dq.V2)4CqI in complex with peptide (KR)5
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-12-06 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 51.110, 89.250, 107.190 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.130 - 1.530 |
R-factor | 0.208 |
Rwork | 0.206 |
R-free | 0.23700 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.000 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | BUSTER (2.10.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.130 | 1.570 |
High resolution limit [Å] | 1.530 | 1.530 |
Rmerge | 0.093 | 1.203 |
Number of reflections | 74727 | |
<I/σ(I)> | 16.98 | 0.56 |
Completeness [%] | 99.9 | 100 |
Redundancy | 12.9 | 6.2 |
CC(1/2) | 1.000 | 0.104 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 277 | 25% PEG 2000 MME, 0.3M NaAcetate, 0.1M Tris, pH8.5 |