7QLV
Endothiapepsin in 5% DMSO at 100 K
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-09-08 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 45.529, 73.509, 53.289 |
Unit cell angles | 90.00, 110.20, 90.00 |
Refinement procedure
Resolution | 35.150 - 1.410 |
R-factor | 0.1888 |
Rwork | 0.187 |
R-free | 0.21590 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6rsv |
RMSD bond length | 0.012 |
RMSD bond angle | 1.272 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.150 | 1.460 |
High resolution limit [Å] | 1.410 | 1.410 |
Rmeas | 0.140 | 1.880 |
Number of reflections | 63364 | 6284 |
<I/σ(I)> | 11.1 | 1.06 |
Completeness [%] | 99.9 | 99.37 |
Redundancy | 6.86 | 6.91 |
CC(1/2) | 0.990 | 0.600 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 293 | 0.1 M ammonium acetate, 0.1 M sodium acetate pH 4.6, and 26 - 30% (v/v) PEG 4000 |