9PKC
Mur35 Fab with HBV c18V pMHC
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-02-15 |
| Detector | DECTRIS EIGER2 X 9M |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 72.533, 72.807, 173.429 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 55.760 - 2.500 |
| R-factor | 0.2598 |
| Rwork | 0.258 |
| R-free | 0.30250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.442 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21_5207) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 72.780 | 2.600 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rpim | 0.074 | 0.682 |
| Number of reflections | 31246 | 3508 |
| <I/σ(I)> | 7.4 | 1 |
| Completeness [%] | 96.7 | |
| Redundancy | 4.4 | |
| CC(1/2) | 0.993 | 0.527 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 300 | 0.15 M NH4F + 15% PEG3350 |
