7E5M
crystal structure of trans assembled human TROP-2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2019-03-14 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97853 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 51.543, 126.882, 54.072 |
| Unit cell angles | 90.00, 118.39, 90.00 |
Refinement procedure
| Resolution | 45.340 - 3.200 |
| R-factor | 0.2483 |
| Rwork | 0.239 |
| R-free | 0.28350 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4mzv |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.689 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.19.2_4158: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.310 |
| High resolution limit [Å] | 3.190 | 3.200 |
| Rmerge | 0.179 | 0.900 |
| Number of reflections | 7911 | 7911 |
| <I/σ(I)> | 8.832 | |
| Completeness [%] | 99.5 | 100 |
| Redundancy | 11.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.2 M potassium iodide, 0.1 M MES, pH 6.5, and 25% w/v PEG 4000 |
