5R64
PanDDA analysis group deposition -- Crystal Structure of HUMAN CLEAVAGE FACTOR IM in complex with FMOPL000464a
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 | 59.850, 59.850, 215.190 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 71.730 - 1.840 |
| R-factor | 0.2109 |
| Rwork | 0.208 |
| R-free | 0.25980 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 3bap |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.800 |
| 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] | 71.730 | 71.730 | 1.890 |
| High resolution limit [Å] | 1.840 | 8.230 | 1.840 |
| Rmerge | 0.085 | 0.025 | 1.921 |
| Rmeas | 0.090 | 0.026 | 2.034 |
| Rpim | 0.030 | 0.009 | 0.662 |
| Total number of observations | 368490 | 4734 | 27144 |
| Number of reflections | 39681 | ||
| <I/σ(I)> | 16.8 | 66.1 | 1.2 |
| Completeness [%] | 99.2 | 99.8 | 100 |
| Redundancy | 9.3 | 8.6 | 9.3 |
| CC(1/2) | 0.999 | 1.000 | 0.583 |
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 |
