9F6X
Human transforming growth factor b type I receptor in complex with kinase inhibitor SB505124
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-07-25 |
| Detector | DECTRIS EIGER2 R 1M |
| Wavelength(s) | 0.87 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 42.070, 79.846, 87.800 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 10.870 - 2.680 |
| R-factor | 0.21399 |
| Rwork | 0.212 |
| R-free | 0.24770 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.012 |
| RMSD bond angle | 2.241 |
| Data reduction software | xia2 |
| Data scaling software | STARANISO |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0430) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 59.070 | 2.740 |
| High resolution limit [Å] | 1.900 | 2.680 |
| Number of reflections | 12847 | 8038 |
| <I/σ(I)> | 8.2 | |
| Completeness [%] | 100.0 | 99.2 |
| Redundancy | 15 | |
| CC(1/2) | 0.997 | 0.360 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 5.6 | 291 | 23%(w/v) PEG 3350, 3%(v/v) glycerol at pH 5.6 |
