5QHP
PanDDA analysis group deposition of models with modelled events (e.g. bound ligands) -- Crystal Structure of human FAM83B in complex with FMOPL000554a
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 | 2017-08-04 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.91587 |
| Spacegroup name | P 41 2 2 |
| Unit cell lengths | 50.490, 50.490, 152.990 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.490 - 2.060 |
| R-factor | 0.186 |
| Rwork | 0.183 |
| R-free | 0.23440 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 5lzk |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.751 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.32) |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 23.230 | 23.230 | 2.110 |
| High resolution limit [Å] | 2.060 | 9.210 | 2.060 |
| Rmerge | 0.118 | 0.036 | 1.533 |
| Rmeas | 0.126 | 0.039 | 1.636 |
| Rpim | 0.043 | 0.015 | 0.564 |
| Total number of observations | 108320 | 1284 | 7911 |
| Number of reflections | 13018 | ||
| <I/σ(I)> | 11.5 | 37.2 | 1.4 |
| Completeness [%] | 99.7 | 94.3 | 99.4 |
| Redundancy | 8.3 | 6.9 | 8.4 |
| CC(1/2) | 0.998 | 0.999 | 0.690 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 27.3% Tacsimate pH 7.0, 0.15 M NaCl |
