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 |