5LNL
Crystal structure of Hsf 1608-1749 putative domain 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-02-20 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.97961 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 128.438, 50.400, 256.796 |
Unit cell angles | 90.00, 101.94, 90.00 |
Refinement procedure
Resolution | 29.600 - 3.300 |
Rwork | 0.296 |
R-free | 0.33380 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3emi |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 29.600 | 29.600 | 3.530 |
High resolution limit [Å] | 3.300 | 9.330 | 3.300 |
Rmerge | 0.333 | 0.044 | 1.114 |
Rmeas | 0.441 | ||
Rpim | 0.286 | ||
Total number of observations | 50038 | ||
Number of reflections | 24219 | ||
<I/σ(I)> | 2.7 | ||
Completeness [%] | 97.7 | 94.1 | 97.8 |
Redundancy | 2.1 | 1.9 | 2.1 |
CC(1/2) | 0.962 | 0.995 | 0.490 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 3.9 | 293 | 0.75 M LiCl, 0.1 M Sodium citrate buffer pH 3.9, 17.6 % (w/v) PEG6000 |