7DVN
Crystal structure of a MarR family protein in complex with a lipid-like effector molecule from the psychrophilic bacterium Paenisporosarcina sp. TG-14
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 5C (4A) |
Synchrotron site | PAL/PLS |
Beamline | 5C (4A) |
Temperature [K] | 95 |
Detector technology | PIXEL |
Collection date | 2018-11-21 |
Detector | DECTRIS EIGER2 X 9M |
Wavelength(s) | 0.9794 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 65.524, 65.524, 90.310 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 32.340 - 1.600 |
R-factor | 0.2265 |
Rwork | 0.225 |
R-free | 0.25470 |
Structure solution method | SAD |
RMSD bond length | 0.017 |
RMSD bond angle | 1.871 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | AutoSol |
Refinement software | REFMAC (1.14_3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.630 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.074 | 0.422 |
Number of reflections | 26268 | 1300 |
<I/σ(I)> | 82.4 | |
Completeness [%] | 98.0 | |
Redundancy | 26.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 296 | 1.6M ammonium citrate tribasic |