8X8I
The structure of AbBioc in complex with SAM cofactor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-11-26 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97915 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 71.055, 57.230, 143.671 |
| Unit cell angles | 90.00, 101.72, 90.00 |
Refinement procedure
| Resolution | 70.340 - 2.540 |
| R-factor | 0.2388 |
| Rwork | 0.236 |
| R-free | 0.28750 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.587 |
| Data reduction software | autoPROC |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.17.1_3660: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.340 | 2.670 |
| High resolution limit [Å] | 2.540 | 2.540 |
| Rmerge | 0.108 | 0.665 |
| Rmeas | 0.130 | 0.796 |
| Rpim | 0.072 | 0.433 |
| Total number of observations | 119796 | 17777 |
| Number of reflections | 37646 | 5458 |
| <I/σ(I)> | 9.4 | 2.4 |
| Completeness [%] | 99.3 | |
| Redundancy | 3.2 | 3.3 |
| CC(1/2) | 0.993 | 0.682 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 290 | 30% (v/v) PEG 400 and 0.1M CAPS/Sodium hydroxide pH 10.5 |
