6YVR
Crystal structure of the neurotensin receptor 1 in complex with the peptide full agonist NTS8-13
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 | 2017-06-25 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.000031 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 89.886, 114.001, 195.424 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.633 - 2.458 |
| Rwork | 0.228 |
| R-free | 0.23750 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4xee |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.265 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.633 | 2.647 |
| High resolution limit [Å] | 2.458 | 2.458 |
| Rmerge | 0.094 | 1.711 |
| Rmeas | 0.098 | 1.801 |
| Rpim | 0.028 | 0.555 |
| Number of reflections | 59974 | 3000 |
| <I/σ(I)> | 15.2 | 1.6 |
| Completeness [%] | 93.9 | |
| Redundancy | 12 | |
| CC(1/2) | 0.999 | 0.597 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 9.4 | 277.1 | 50mM glycine 1M NaCl 8.3% (w/v) PEG4000 Cryoprotectant solution contained: 50mM glycine pH 9.4 1M NaCl 100nM NTS8-13 15% (v/v) PEG600 15% (v/v) glycerol |
