5S8B
XChem group deposition -- Crystal Structure of human ACVR1 in complex with FM010960a
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 | 127.217, 84.799, 88.167 |
| Unit cell angles | 90.00, 130.98, 90.00 |
Refinement procedure
| Resolution | 66.560 - 1.640 |
| R-factor | 0.1996 |
| Rwork | 0.198 |
| R-free | 0.23340 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 6srh |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.544 |
| 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] | 66.620 | 66.620 | 1.670 |
| High resolution limit [Å] | 1.640 | 4.450 | 1.640 |
| Rmerge | 0.184 | 0.070 | 2.133 |
| Number of reflections | 86278 | ||
| <I/σ(I)> | 6.2 | 24.8 | 0.5 |
| Completeness [%] | 100.0 | 100 | 100 |
| CC(1/2) | 0.990 | 0.990 | 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 |
