7GAO
PanDDA analysis group deposition -- Crystal Structure of MAP1LC3B in complex with Z57450788
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 | 61.070, 61.070, 35.296 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.580 - 1.690 |
| R-factor | 0.1933 |
| Rwork | 0.192 |
| R-free | 0.21810 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8q53 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.459 |
| 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] | 30.560 | 30.560 | 1.720 |
| High resolution limit [Å] | 1.690 | 9.110 | 1.690 |
| Rmerge | 0.262 | ||
| Rmeas | 0.273 | 0.154 | 13.865 |
| Rpim | 0.074 | 0.047 | 3.716 |
| Total number of observations | 201357 | 1157 | 10272 |
| Number of reflections | 14738 | 107 | 749 |
| <I/σ(I)> | 10.2 | 42.9 | 0.5 |
| Completeness [%] | 99.9 | 98.6 | 99.1 |
| Redundancy | 13.7 | 10.8 | 13.7 |
| CC(1/2) | 0.997 | 0.996 | 0.345 |
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 |
