6DLC
Designed protein DHD1:234_A, Designed protein DHD1:234_B
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-12-14 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.999954 |
Spacegroup name | P 64 |
Unit cell lengths | 96.885, 96.885, 27.846 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 48.440 - 3.261 |
R-factor | 0.2614 |
Rwork | 0.258 |
R-free | 0.28550 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | Computational Design Model |
RMSD bond length | 0.003 |
RMSD bond angle | 0.638 |
Data reduction software | XDS (June 17, 2015) |
Data scaling software | XDS (June 17, 2015) |
Phasing software | PHASER (2.5.6.) |
Refinement software | PHENIX (dev_3112) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.440 | 3.520 |
High resolution limit [Å] | 3.260 | 3.260 |
Rmerge | 0.125 | 1.343 |
Rmeas | 0.135 | 1.440 |
Rpim | 0.049 | 0.708 |
Number of reflections | 2485 | 512 |
<I/σ(I)> | 9.7 | 1.7 |
Completeness [%] | 99.8 | 99.6 |
Redundancy | 7.6 | 7.8 |
CC(1/2) | 0.999 | 0.472 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 290.15 | 0.15M Potassium bromide, 30% (w/v) PEG 2,000 MME, plus 20% glycerol as cryoprotectant |