5XTW
Crystal structure of the CysR-CTLD2 fragment of human MR at acidic pH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NFPSS BEAMLINE BL19U1 |
| Synchrotron site | NFPSS |
| Beamline | BL19U1 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2017-05-04 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.987 |
| Spacegroup name | P 1 |
| Unit cell lengths | 43.819, 164.768, 164.596 |
| Unit cell angles | 91.11, 97.56, 97.50 |
Refinement procedure
| Resolution | 27.942 - 3.200 |
| R-factor | 0.2118 |
| Rwork | 0.211 |
| R-free | 0.24790 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5xts |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.518 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.942 | 3.260 |
| High resolution limit [Å] | 3.200 | 3.200 |
| Rmerge | 0.141 | 0.382 |
| Number of reflections | 72181 | |
| <I/σ(I)> | 7.8 | 2.091 |
| Completeness [%] | 96.1 | 96.1 |
| Redundancy | 3.6 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 291.15 | 6% (v/v) tacsimate (pH 6.0), 0.1M MES monohydrate (pH 6.0), 25% (w/v) polyethylene glycol 4,000 |
