5MV3
ACC1 Fab fragment in complex with CII583-591 (CG10)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-10-16 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9184 |
Spacegroup name | P 1 |
Unit cell lengths | 87.353, 92.844, 121.706 |
Unit cell angles | 92.50, 106.53, 104.31 |
Refinement procedure
Resolution | 50.010 - 2.950 |
R-factor | 0.20442 |
Rwork | 0.202 |
R-free | 0.26098 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5mu0 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.471 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.900 | 3.010 |
High resolution limit [Å] | 2.950 | 2.950 |
Rmerge | 0.073 | 0.511 |
Number of reflections | 73522 | 4569 |
<I/σ(I)> | 11.4 | 1.8 |
Completeness [%] | 99.0 | 98.6 |
Redundancy | 3.2 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 20% (w/v) PEG3350, 0.1 M Bistris-Propane pH 7.0, 0.2 M sodium acetate |