8XMZ
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 65 2 2 |
| Unit cell lengths | 95.614, 95.614, 215.531 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 32.950 - 2.500 |
| R-factor | 0.2635 |
| Rwork | 0.260 |
| R-free | 0.29940 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.653 |
| 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] | 47.810 | 2.600 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.091 | 1.158 |
| Rmeas | 0.094 | 1.188 |
| Rpim | 0.021 | 0.264 |
| Total number of observations | 398629 | 45470 |
| Number of reflections | 21013 | 2302 |
| <I/σ(I)> | 26.3 | 3.5 |
| Completeness [%] | 99.9 | |
| Redundancy | 19 | 19.8 |
| CC(1/2) | 1.000 | 0.979 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.2 M Ammonium sulfate, 0.1 M MES monohydrate pH 6.5, 30% w/v Polyethylene glycol monomethyl ether 5,000 |
