9JOF
COMPLEX STRUCTURE OF ENDO-1,3-FUCANASE (FUN168D) FROM GH168 FAMILY WITH FUCOTRIOSE
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 | 2023-04-07 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97853 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.819, 138.329, 63.062 |
| Unit cell angles | 90.00, 113.79, 90.00 |
Refinement procedure
| Resolution | 30.240 - 1.500 |
| R-factor | 0.1414 |
| Rwork | 0.141 |
| R-free | 0.16910 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.090 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.160 | 1.530 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.040 | 0.147 |
| Rmeas | 0.048 | 0.190 |
| Rpim | 0.026 | 0.118 |
| Total number of observations | 430391 | 13077 |
| Number of reflections | 135276 | 6100 |
| <I/σ(I)> | 18.8 | 5.1 |
| Completeness [%] | 98.8 | |
| Redundancy | 3.2 | 2.1 |
| CC(1/2) | 0.998 | 0.958 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 290 | 10% v/v 2-Propanol+20% w/v Polyethylene glycol 4,000+1 M HEPES sodium,pH 7.5 |
