8UTL
Bovine trypsin in complex with Thr3Dap mutated microviridin J
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS-II BEAMLINE 17-ID-1 |
Synchrotron site | NSLS-II |
Beamline | 17-ID-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-07-06 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.9201 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 71.476, 71.476, 73.297 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 28.510 - 1.560 |
R-factor | 0.17328 |
Rwork | 0.172 |
R-free | 0.19431 |
Structure solution method | MOLECULAR REPLACEMENT |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | REFMAC (8.0.013) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.510 | 1.616 |
High resolution limit [Å] | 1.560 | 1.560 |
Rmerge | 0.129 | 0.678 |
Rmeas | 0.140 | 0.736 |
Number of reflections | 31088 | 2984 |
<I/σ(I)> | 9.87 | 2.39 |
Completeness [%] | 99.4 | 96.91 |
Redundancy | 6.6 | 6.3 |
CC(1/2) | 0.992 | 0.862 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 295.37 | 0.2 M ammonium sulfate, 0.1 M sodium cacodylate pH 5.5, 15% PEG 8000 |