8JIY
A carbohydrate binding domain of a putative chondroitinase
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 | 2023-04-08 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 56.313, 56.634, 69.456 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.560 - 1.550 |
| R-factor | 0.1928 |
| Rwork | 0.191 |
| R-free | 0.22840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.767 |
| 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] | 43.890 | 1.580 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.056 | 0.238 |
| Rmeas | 0.062 | 0.271 |
| Rpim | 0.026 | 0.127 |
| Total number of observations | 169904 | 6887 |
| Number of reflections | 32725 | 1596 |
| <I/σ(I)> | 17 | 4.4 |
| Completeness [%] | 99.4 | |
| Redundancy | 5.2 | 4.3 |
| CC(1/2) | 0.998 | 0.937 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 20% PEG 3350, 0.2 M Ammonium sulfate |
