7XPR
Crystal structrue of SeMet-MtdL:GDP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-05-13 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 162.213, 97.483, 57.923 |
| Unit cell angles | 90.00, 97.32, 90.00 |
Refinement procedure
| Resolution | 19.770 - 2.100 |
| R-factor | 0.2123 |
| Rwork | 0.211 |
| R-free | 0.24290 |
| Structure solution method | SAD |
| Data reduction software | XDS |
| Data scaling software | SCALA (3.3.22) |
| Phasing software | SHELXCD |
| Refinement software | PHENIX (1.11) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 83.373 | 19.770 | 2.210 |
| High resolution limit [Å] | 2.100 | 6.640 | 2.100 |
| Rmerge | 0.045 | 0.825 | |
| Rmeas | 0.136 | 0.059 | 0.982 |
| Rpim | 0.051 | 0.023 | 0.380 |
| Total number of observations | 353130 | 10271 | 48183 |
| Number of reflections | 51416 | 1593 | 7407 |
| <I/σ(I)> | 10.8 | 29.6 | 2.2 |
| Completeness [%] | 98.7 | 93.6 | 98.2 |
| Redundancy | 6.9 | 6.4 | 6.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 283 | 1.0 M lithium chloride, 0.1 M citric acid, pH 5.0, 10% (w/v) PEG6000 |
