8UIH
anti-Phosphohistidine Fab hSC44.ck.20 with 3pTza peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-D |
| Synchrotron site | APS |
| Beamline | 23-ID-D |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-04-25 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.03320 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 79.958, 73.115, 88.071 |
| Unit cell angles | 90.00, 111.24, 90.00 |
Refinement procedure
| Resolution | 41.040 - 1.850 |
| R-factor | 0.2069 |
| Rwork | 0.205 |
| R-free | 0.24340 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.746 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.040 | 1.880 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.131 | 1.280 |
| Rmeas | 0.151 | 1.510 |
| Rpim | 0.074 | 0.790 |
| Number of reflections | 40163 | 1984 |
| <I/σ(I)> | 9.8 | 0.98 |
| Completeness [%] | 99.8 | 99.4 |
| Redundancy | 3.9 | 3.3 |
| CC(1/2) | 0.991 | 0.362 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2M tri-potassium citrate, 20% PEG3350 |
