9QC1
Crystal structure of the neurotensin receptor 1 in complex with the small-molecule full agonist cp28a
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-06-26 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 75.661, 215.887, 95.623 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 107.900 - 3.124 |
| Rwork | 0.300 |
| R-free | 0.32200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.900 |
| Data scaling software | XDS |
| Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 107.900 | 3.470 |
| High resolution limit [Å] | 3.120 | 3.120 |
| Rmerge | 0.220 | 4.700 |
| Rpim | 0.050 | 0.970 |
| Number of reflections | 9464 | 473 |
| <I/σ(I)> | 10.8 | 1.4 |
| Completeness [%] | 87.8 | 43.6 |
| Redundancy | 25.6 | |
| CC(1/2) | 0.990 | 0.200 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIPIDIC CUBIC PHASE | 4.5 | 293.15 | 100 mM Na acetate 350 mM K citrate tribasic 30% (v/v) PEG400 50 uM cp28a |
