5FJ0
Structure of the standard kink turn HmKt-7 as simple duplex in P4222 space group
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 173 |
Detector technology | PIXEL |
Collection date | 2014-02-25 |
Detector | DECTRIS PILATUS |
Spacegroup name | P 42 2 2 |
Unit cell lengths | 50.504, 50.504, 144.953 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.692 - 2.200 |
R-factor | 0.2047 |
Rwork | 0.203 |
R-free | 0.23720 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4cs1 |
RMSD bond length | 0.002 |
RMSD bond angle | 0.418 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.320 | 2.270 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.040 | 0.880 |
Number of reflections | 10187 | |
<I/σ(I)> | 26.6 | 1.3 |
Completeness [%] | 100.0 | 100 |
Redundancy | 10.2 | 10.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | 0.04 M MAGNESIUM CHLORIDE 0.05 M SODIUM CACODYLATE PH 6.0 5% V/V 2-METHYL-2,4-PENTANEDIOL |