9OJ3
Crystal structure of the SpyTag003-SpyCatcher003 complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 2.0.1 |
Synchrotron site | ALS |
Beamline | 2.0.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-11-18 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.338, 67.490, 70.072 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.610 - 1.430 |
R-factor | 0.135 |
Rwork | 0.134 |
R-free | 0.14880 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.389 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.610 | 1.480 |
High resolution limit [Å] | 1.430 | 1.430 |
Rmerge | 0.077 | |
Number of reflections | 40513 | 2727 |
<I/σ(I)> | 11.32 | |
Completeness [%] | 94.8 | |
Redundancy | 2 | |
CC(1/2) | 0.992 | 0.696 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 295 | Ammonium sulfate 0.2M, NaCl 200mM, PEG8000 30%, Anderson-Evans polyoxotungstate "TEW" additive 1mM, Glycerol 5% |