6TBG
Structure of a beta galactosidase with inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-04-23 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 1 |
| Unit cell lengths | 99.285, 115.735, 115.981 |
| Unit cell angles | 90.12, 90.00, 90.03 |
Refinement procedure
| Resolution | 115.980 - 1.500 |
| R-factor | 0.1401 |
| Rwork | 0.138 |
| R-free | 0.18170 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4d1i |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.444 |
| Data reduction software | DIALS |
| Data scaling software | Aimless |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0253) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 115.980 | 1.530 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.049 | |
| Number of reflections | 798304 | 38786 |
| <I/σ(I)> | 11 | |
| Completeness [%] | 96.5 | 94.4 |
| Redundancy | 3.5 | 3.5 |
| CC(1/2) | 0.998 | 0.644 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | sodium acetate |
