5S84
XChem group deposition -- Crystal Structure of human ACVR1 in complex with FM010949a
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-01-17 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9762 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 126.769, 84.763, 87.680 |
Unit cell angles | 90.00, 130.84, 90.00 |
Refinement procedure
Resolution | 48.000 - 1.350 |
R-factor | 0.1664 |
Rwork | 0.165 |
R-free | 0.19130 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 6srh |
RMSD bond length | 0.012 |
RMSD bond angle | 1.734 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 47.980 | 47.980 | 1.370 |
High resolution limit [Å] | 1.350 | 3.660 | 1.350 |
Rmerge | 0.068 | 0.028 | 1.482 |
Number of reflections | 124784 | ||
<I/σ(I)> | 12.6 | 60 | 0.3 |
Completeness [%] | 81.7 | 100 | 20.2 |
CC(1/2) | 1.000 | 1.000 | 0.330 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 277 | 0.1M citrate pH 6.0, 1.4M ammonium sulfate, 0.2M sodium/potassium tartrate |