6VDO
HCV NS3/4A protease A156T, D168E double mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2019-11-08 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 55.019, 58.587, 61.636 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.050 - 2.110 |
R-factor | 0.1963 |
Rwork | 0.194 |
R-free | 0.23510 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6p6m |
RMSD bond length | 0.006 |
RMSD bond angle | 0.714 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.15.2_3472) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.050 | 2.187 |
High resolution limit [Å] | 2.110 | 2.111 |
Number of reflections | 11839 | 1088 |
<I/σ(I)> | 15.4 | |
Completeness [%] | 99.2 | |
Redundancy | 6.4 | |
CC(1/2) | 0.998 | 0.945 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 278 | 0.1M MES pH 6.5 2% Ammonium sulfate 20-25% PEG3350 |