5R65
PanDDA analysis group deposition -- Crystal Structure of HUMAN CLEAVAGE FACTOR IM in complex with FMOPL000387a
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 | 59.630, 59.630, 215.040 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 71.780 - 2.280 |
| R-factor | 0.2121 |
| Rwork | 0.208 |
| R-free | 0.27860 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 3bap |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.615 |
| 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] | 107.520 | 107.520 | 2.340 |
| High resolution limit [Å] | 2.280 | 10.200 | 2.280 |
| Rmerge | 0.218 | 0.047 | 9.819 |
| Rmeas | 0.232 | 0.050 | 10.471 |
| Rpim | 0.076 | 0.017 | 3.571 |
| Total number of observations | 194263 | 2340 | 12390 |
| Number of reflections | 21066 | ||
| <I/σ(I)> | 9.2 | 32 | 0.4 |
| Completeness [%] | 99.5 | 99.5 | 95.1 |
| Redundancy | 9.2 | 7.8 | 8.6 |
| CC(1/2) | 0.996 | 0.998 | 0.506 |
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 |
