8ZQF
Crystal structure of a novel alginate-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 | 2024-04-21 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97907 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 38.950, 64.360, 41.440 |
| Unit cell angles | 90.00, 110.80, 90.00 |
Refinement procedure
| Resolution | 19.370 - 1.500 |
| R-factor | 0.1831 |
| Rwork | 0.181 |
| R-free | 0.21400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.877 |
| 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] | 19.370 | 1.530 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.119 | 0.231 |
| Rmeas | 0.129 | 0.251 |
| Rpim | 0.051 | 0.096 |
| Total number of observations | 196600 | 9936 |
| Number of reflections | 30419 | 1471 |
| <I/σ(I)> | 13.5 | 9.7 |
| Completeness [%] | 99.3 | |
| Redundancy | 6.5 | 6.8 |
| CC(1/2) | 0.989 | 0.966 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 2.1 M DL-Malic acid pH 7.0 |
