7EE5
Crystal structure of Neu5Gc bound PltC
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 | 2019-05-29 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9785 |
| Spacegroup name | H 3 |
| Unit cell lengths | 189.094, 189.094, 41.207 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 27.760 - 1.240 |
| R-factor | 0.1393 |
| Rwork | 0.138 |
| R-free | 0.16040 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5wht |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.945 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.760 | 1.285 |
| High resolution limit [Å] | 1.240 | 1.240 |
| Rmeas | 0.068 | 0.521 |
| Number of reflections | 155226 | 15252 |
| <I/σ(I)> | 31.3 | |
| Completeness [%] | 99.7 | |
| Redundancy | 9.8 | 7.9 |
| CC(1/2) | 1.000 | 0.930 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 291 | 34% PEG500MME and 0.1M sodium citrate |
