6UMJ
Crystal structure of erenumab Fab-c
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-08-12 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 73.481, 73.481, 177.167 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 30.000 - 2.700 |
R-factor | 0.2269 |
Rwork | 0.225 |
R-free | 0.26710 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.004 |
RMSD bond angle | 0.836 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 30.000 | 30.000 | 2.800 |
High resolution limit [Å] | 2.700 | 5.800 | 2.700 |
Rmerge | 0.171 | 0.127 | 0.744 |
Rmeas | 0.176 | 0.131 | 0.761 |
Rpim | 0.038 | 0.030 | 0.161 |
Total number of observations | 336957 | ||
Number of reflections | 15692 | 1723 | 1506 |
<I/σ(I)> | 7.1 | ||
Completeness [%] | 98.9 | 99.9 | 98 |
Redundancy | 21.5 | 19.7 | 21.9 |
CC(1/2) | 0.987 | 0.950 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 277 | 0.1 M sodium acetate, pH 5.0, 30% MPD, 5% 1,3-butanediol |