7GAN
PanDDA analysis group deposition -- Crystal Structure of MAP1LC3B in complex with Z56767614
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-02-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92124 |
| Spacegroup name | P 43 |
| Unit cell lengths | 61.091, 61.091, 35.540 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.240 - 2.090 |
| R-factor | 0.1917 |
| Rwork | 0.189 |
| R-free | 0.25590 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8q53 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.482 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.7) |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 43.190 | 43.190 | 2.150 |
| High resolution limit [Å] | 2.090 | 9.110 | 2.090 |
| Rmerge | 0.124 | 0.057 | 3.388 |
| Rmeas | 0.129 | 0.061 | 3.517 |
| Rpim | 0.035 | 0.019 | 0.937 |
| Total number of observations | 106979 | 1133 | 8388 |
| Number of reflections | 7949 | 110 | 608 |
| <I/σ(I)> | 10.4 | 41.4 | 0.5 |
| Completeness [%] | 99.9 | 99.2 | 99.3 |
| Redundancy | 13.5 | 10.3 | 13.8 |
| CC(1/2) | 0.997 | 0.994 | 0.378 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.7 | 293 | 36% PEG 8000, 0.1M acetate pH 4.7 |
