5R67
PanDDA analysis group deposition -- Crystal Structure of HUMAN CLEAVAGE FACTOR IM in complex with FMOPL000589a
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 | 2017-07-08 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92819 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 59.770, 59.770, 214.230 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.650 - 1.520 |
| R-factor | 0.2108 |
| Rwork | 0.209 |
| R-free | 0.24520 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 3bap |
| RMSD bond length | 0.015 |
| RMSD bond angle | 2.067 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.32) |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 46.610 | 46.610 | 1.560 |
| High resolution limit [Å] | 1.520 | 6.800 | 1.520 |
| Rmerge | 0.060 | 0.037 | 2.223 |
| Rmeas | 0.063 | 0.039 | 2.367 |
| Rpim | 0.020 | 0.013 | 0.807 |
| Total number of observations | 672004 | 8082 | 42834 |
| Number of reflections | 69626 | ||
| <I/σ(I)> | 17.5 | 60.9 | 1 |
| Completeness [%] | 99.9 | 99.7 | 100 |
| Redundancy | 9.7 | 8.7 | 8.5 |
| CC(1/2) | 0.999 | 0.999 | 0.499 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.1 | 277 | 0.1M acetate pH 5.1, 0.0025M ZnAC, 6% PEG3K |
