7U9J
Crystal structure of Mesothelin-207 fragment
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-B |
| Synchrotron site | APS |
| Beamline | 23-ID-B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-08-02 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9793 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 96.762, 78.611, 74.332 |
| Unit cell angles | 90.00, 108.15, 90.00 |
Refinement procedure
| Resolution | 33.990 - 2.090 |
| R-factor | 0.1728 |
| Rwork | 0.171 |
| R-free | 0.21630 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4f3f |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.604 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.180 |
| High resolution limit [Å] | 2.090 | 2.091 |
| Rmerge | 0.103 | 0.291 |
| Number of reflections | 27430 | 2180 |
| <I/σ(I)> | 5.571 | |
| Completeness [%] | 87.9 | |
| Redundancy | 2.4 | |
| CC(1/2) | 0.981 | 0.754 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 289 | 0.1 M HEPES, pH 7.5, 100 mM potassium chloride, 12.5% PEG3350, 100 mM lithium sulfate |
