8UWQ
Crystal structure of BT1282 GH18-like from Bacteroides thetaiotaomicron VPI-5482
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-06-12 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 188.936, 75.995, 112.160 |
| Unit cell angles | 90.00, 121.29, 90.00 |
Refinement procedure
| Resolution | 27.130 - 2.360 |
| R-factor | 0.1748 |
| Rwork | 0.173 |
| R-free | 0.20760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.021 |
| 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] | 27.300 | 2.390 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Rmerge | 0.130 | 0.611 |
| Rmeas | 0.141 | 0.668 |
| Rpim | 0.054 | 0.266 |
| Number of reflections | 54723 | 2718 |
| <I/σ(I)> | 12.25 | 2.18 |
| Completeness [%] | 98.8 | 99.6 |
| Redundancy | 6.7 | 6.2 |
| CC(1/2) | 0.992 | 0.867 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M BIS-TRIS pH 5.5, 25% w/v Polyethylene glycol 3,350 (Index D6) |
