7X86
The crystal structure of PloI4-F124L in complex with endo-4+2 adduct
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 | 2021-11-09 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97915 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 180.980, 88.810, 50.770 |
| Unit cell angles | 90.00, 92.73, 90.00 |
Refinement procedure
| Resolution | 90.387 - 2.303 |
| R-factor | 0.2138 |
| Rwork | 0.212 |
| R-free | 0.25250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7x80 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 90.390 | 2.340 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.296 | 0.831 |
| Number of reflections | 35426 | 1720 |
| <I/σ(I)> | 6.8 | 2.4 |
| Completeness [%] | 99.5 | 98.1 |
| Redundancy | 9.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 289 | 1.6 M Sodium phosphate monobasic, 400 mM Potassium phosphate dibasic, 100 mM Sodium phosphate dibasic/Citric acid (pH 4.2) |
