5D7W
Crystal structure of serralysin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-04-02 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9792 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 42.300, 105.400, 151.100 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.628 - 1.100 |
R-factor | 0.1759 |
Rwork | 0.175 |
R-free | 0.18610 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4i35 |
RMSD bond length | 0.005 |
RMSD bond angle | 1.019 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.200 |
High resolution limit [Å] | 1.100 | 1.100 |
Rmerge | 0.091 | |
Number of reflections | 273151 | |
<I/σ(I)> | 10.96 | 2.03 |
Completeness [%] | 99.5 | 99.5 |
Redundancy | 7.01 | 6.82 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.3 | 289 | PEG 8000,Ammonium sulfate,sodium citrate |