5S81
XChem group deposition -- Crystal Structure of human ACVR1 in complex with FM010947a
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 | 127.326, 84.704, 88.116 |
| Unit cell angles | 90.00, 130.99, 90.00 |
Refinement procedure
| Resolution | 66.510 - 1.430 |
| R-factor | 0.1699 |
| Rwork | 0.169 |
| R-free | 0.19590 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 6srh |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.711 |
| 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] | 66.580 | 66.580 | 1.450 |
| High resolution limit [Å] | 1.430 | 3.880 | 1.430 |
| Rmerge | 0.089 | 0.046 | 1.857 |
| Number of reflections | 107371 | ||
| <I/σ(I)> | 11.3 | 45.9 | 0.4 |
| Completeness [%] | 82.9 | 99.5 | 31.5 |
| 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 |
