6INU
Crystal structure of the CysR-CTLD2 fragment of human MR at acidic pH (pH 4.6)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NFPSS BEAMLINE BL18U |
| Synchrotron site | NFPSS |
| Beamline | BL18U |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2017-12-29 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.98 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 238.763, 74.122, 109.968 |
| Unit cell angles | 90.00, 114.74, 90.00 |
Refinement procedure
| Resolution | 29.570 - 2.650 |
| R-factor | 0.2164 |
| Rwork | 0.215 |
| R-free | 0.25800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5xts |
| RMSD bond length | 0.010 |
| RMSD bond angle | 0.949 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.740 |
| High resolution limit [Å] | 2.650 | 2.650 |
| Rmerge | 0.100 | 0.409 |
| Number of reflections | 50653 | 4940 |
| <I/σ(I)> | 17.8 | |
| Completeness [%] | 99.4 | |
| Redundancy | 5.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291.15 | 0.01 M cobalt chloride hexahydrate, 0.1 M sodium acetate trihydrate (pH 4.6), 1.0 M 1,6-Hexanediol |
