7UJ6
Outer Surface Protein C Type K
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-06-20 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 52.316, 52.343, 116.682 |
| Unit cell angles | 90.00, 92.49, 90.00 |
Refinement procedure
| Resolution | 39.782 - 1.951 |
| R-factor | 0.1945 |
| Rwork | 0.193 |
| R-free | 0.22760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ggq |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.517 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.980 |
| High resolution limit [Å] | 1.950 | 5.290 | 1.950 |
| Rmerge | 0.149 | 0.054 | 1.311 |
| Rmeas | 0.165 | 0.059 | 1.464 |
| Rpim | 0.071 | 0.024 | 0.639 |
| Total number of observations | 237937 | ||
| Number of reflections | 45203 | 2386 | 2233 |
| <I/σ(I)> | 6.1 | ||
| Completeness [%] | 97.8 | 99 | 99.2 |
| Redundancy | 5.3 | 6 | 5 |
| CC(1/2) | 0.998 | 0.535 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 295 | 100 mM Tris pH 8.5, 40% PEG 400, 200 mM Li2SO4, 10 mM 2-Aminoethanesulfonic acid. |
