8WAE
Crystal structure of a novel porphyran-binding carbohydrate binding module
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 | 2023-07-02 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9785 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 25.079, 49.421, 160.895 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 24.780 - 1.750 |
| R-factor | 0.1618 |
| Rwork | 0.157 |
| R-free | 0.20680 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.868 |
| 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] | 49.420 | 1.780 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.050 | 0.095 |
| Rmeas | 0.055 | 0.106 |
| Rpim | 0.022 | 0.046 |
| Total number of observations | 130924 | 5930 |
| Number of reflections | 21203 | 1150 |
| <I/σ(I)> | 25.8 | 13.3 |
| Completeness [%] | 100.0 | |
| Redundancy | 6.2 | 5.2 |
| CC(1/2) | 0.998 | 0.992 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.2 M Ammonium sulfate, 30% w/v Polyethylene glycol 4,000 |
