8RZJ
ZgGH129 from Zobellia galactanivorans in complex with the inhibitor ADG-IF (3,6-anhydro-D-galacto-isofagomine).
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-02-01 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9801 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 218.781, 106.120, 164.695 |
| Unit cell angles | 90.00, 113.92, 90.00 |
Refinement procedure
| Resolution | 47.380 - 1.990 |
| R-factor | 0.1555 |
| Rwork | 0.154 |
| R-free | 0.18510 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.183 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.16-3549) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.220 | 2.090 |
| High resolution limit [Å] | 1.990 | 1.990 |
| Rmeas | 0.155 | 1.168 |
| Number of reflections | 232909 | 32888 |
| <I/σ(I)> | 8.3 | 1.6 |
| Completeness [%] | 98.3 | 95.3 |
| Redundancy | 7 | 7 |
| CC(1/2) | 0.995 | 0.689 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 1.63 mg/ml 2:1 ratio 0.14M Na/K-tartrate, 14% PEG 3350 |
