7Q8N
Peptide KKYDAFLA in complex with human cathepsin V C25A mutant
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ELETTRA BEAMLINE 11.2C |
Synchrotron site | ELETTRA |
Beamline | 11.2C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-07-31 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 94.150, 94.150, 126.100 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.780 - 2.000 |
R-factor | 0.1735 |
Rwork | 0.173 |
R-free | 0.19960 |
Structure solution method | SAD |
Starting model (for MR) | 1fh0 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | MAIN |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.080 | 2.050 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 38878 | 2820 |
<I/σ(I)> | 15.8 | |
Completeness [%] | 100.0 | |
Redundancy | 14.3 | |
CC(1/2) | 0.999 | 0.818 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 278 | 77 % MPD, 23 % of 60 mM Tris, pH 8 |