6V2E
Crystal structure of the human CLR:RAMP2 extracellular domain heterodimer with bound high-affinity adrenomedullin S45R/K46L/S48G/Q50W variant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-G |
Synchrotron site | APS |
Beamline | 21-ID-G |
Temperature [K] | 105 |
Detector technology | CCD |
Collection date | 2018-12-01 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.9786 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 68.017, 84.993, 123.064 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.970 - 1.830 |
R-factor | 0.1582 |
Rwork | 0.157 |
R-free | 0.18960 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4rwf |
RMSD bond length | 0.010 |
RMSD bond angle | 1.530 |
Data reduction software | HKL-2000 (v.712) |
Data scaling software | HKL-2000 (v.712) |
Phasing software | PHASER (2.8.2) |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.860 |
High resolution limit [Å] | 1.830 | 4.970 | 1.830 |
Rmerge | 0.087 | 0.029 | 1.180 |
Rmeas | 0.093 | 0.031 | 1.274 |
Rpim | 0.034 | 0.012 | 0.476 |
Total number of observations | 468938 | ||
Number of reflections | 63239 | 3416 | 3064 |
<I/σ(I)> | 6.8 | ||
Completeness [%] | 99.6 | 99.6 | 98.9 |
Redundancy | 7.4 | 6.9 | 6.9 |
CC(1/2) | 0.999 | 0.631 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.3 | 293 | 20% PEG MME 5000, 0.1 M sodium HEPEs pH 8.2, 150 mM sodium formate, 3% (v/v) dimethyl sulfoxide |