5O4G
HER2 in complex with Fab MF3958
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-03-07 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.00002 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.790, 113.500, 113.490 |
Unit cell angles | 90.00, 101.92, 90.00 |
Refinement procedure
Resolution | 35.835 - 3.000 |
R-factor | 0.2313 |
Rwork | 0.229 |
R-free | 0.27070 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1n8y 3skj 2eh7 |
RMSD bond length | 0.016 |
RMSD bond angle | 0.576 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.835 | 3.160 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.144 | 0.786 |
Rpim | 0.091 | 0.484 |
Number of reflections | 30946 | 4534 |
<I/σ(I)> | 8.6 | 2.5 |
Completeness [%] | 98.9 | 99.6 |
Redundancy | 3.5 | 3.5 |
CC(1/2) | 0.980 | 0.479 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 291 | 0.1 M MES pH 6.0, 15% PEG 6000 |