5MR2
Crystal structure of red abalone VERL repeat 2 with linker at 2.5 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-07-02 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.8729 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 69.920, 79.190, 81.240 |
Unit cell angles | 90.00, 102.62, 90.00 |
Refinement procedure
Resolution | 47.006 - 2.500 |
R-factor | 0.2386 |
Rwork | 0.234 |
R-free | 0.28020 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5iia 5iib 5iic |
RMSD bond length | 0.008 |
RMSD bond angle | 1.132 |
Data reduction software | XDS (May 1, 2016 BUILT=20160617) |
Data scaling software | XDS (May 1, 2016 BUILT=20160617) |
Phasing software | PHASER (2.6.0) |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.010 | 2.589 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.138 | 2.386 |
Number of reflections | 15039 | |
<I/σ(I)> | 7.79 | 0.62 |
Completeness [%] | 100.0 | 100 |
Redundancy | 4.5 | 4.4 |
CC(1/2) | 0.996 | 0.222 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.6 | 293 | 0.2 M ammonium formate pH 6.6, 20% PEG 3350 |