7GAQ
PanDDA analysis group deposition -- Crystal Structure of MAP1LC3B in complex with Z755044716
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 | 61.180, 61.180, 35.470 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.700 - 2.140 |
| R-factor | 0.1906 |
| Rwork | 0.188 |
| R-free | 0.24440 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8q53 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.509 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.9) |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 30.690 | 30.690 | 2.200 |
| High resolution limit [Å] | 2.140 | 9.570 | 2.140 |
| Rmerge | 0.377 | 0.098 | 4.262 |
| Rmeas | 0.392 | 0.103 | 4.426 |
| Rpim | 0.107 | 0.031 | 1.187 |
| Total number of observations | 98511 | 956 | 7335 |
| Number of reflections | 7415 | 95 | 532 |
| <I/σ(I)> | 6.5 | 19.6 | 0.7 |
| Completeness [%] | 100.0 | 98.4 | 100 |
| Redundancy | 13.3 | 10.1 | 13.8 |
| CC(1/2) | 0.995 | 0.997 | 0.217 |
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 |
