7GAF
PanDDA analysis group deposition -- Crystal Structure of MAP1LC3B in complex with Z183352334
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 | 2023-02-08 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92124 |
| Spacegroup name | P 43 |
| Unit cell lengths | 60.798, 60.798, 35.378 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.030 - 1.840 |
| R-factor | 0.1959 |
| Rwork | 0.194 |
| R-free | 0.24540 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8q53 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.591 |
| 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] | 42.980 | 42.980 | 1.880 |
| High resolution limit [Å] | 1.840 | 9.010 | 1.840 |
| Rmerge | 0.088 | 0.037 | 5.554 |
| Rmeas | 0.091 | 0.039 | 5.761 |
| Rpim | 0.025 | 0.012 | 1.526 |
| Total number of observations | 156378 | 1167 | 9812 |
| Number of reflections | 11438 | 112 | 689 |
| <I/σ(I)> | 13.4 | 70.7 | 0.3 |
| Completeness [%] | 100.0 | 99.2 | 99.7 |
| Redundancy | 13.7 | 10.4 | 14.2 |
| CC(1/2) | 0.999 | 0.999 | 0.266 |
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 |
