6JKD
Crystal structure of tetrameric PepTSo2 in I4 space group
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL32XU |
| Synchrotron site | SPring-8 |
| Beamline | BL32XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-12-20 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | I 4 |
| Unit cell lengths | 115.150, 115.150, 110.100 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.650 - 3.900 |
| R-factor | 0.2556 |
| Rwork | 0.252 |
| R-free | 0.28320 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6jkc |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.507 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 4.140 |
| High resolution limit [Å] | 3.900 | 3.900 |
| Rmerge | 0.394 | 1.109 |
| Rmeas | 0.455 | 1.277 |
| Number of reflections | 6448 | 1048 |
| <I/σ(I)> | 4.38 | |
| Completeness [%] | 97.4 | 97.8 |
| Redundancy | 3.6 | 3.7 |
| CC(1/2) | 0.946 | 0.459 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIPIDIC CUBIC PHASE | 4 | 293 | 40% PEG 200, 100 mM Na malonate, pH 7.0, 100 mM Na acetate, pH 4.0 |
