5JUE
Crystal Structure of UIC2 Fab
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-BM |
| Synchrotron site | APS |
| Beamline | 22-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-11-11 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.06882 |
| Spacegroup name | P 1 |
| Unit cell lengths | 40.673, 44.909, 58.094 |
| Unit cell angles | 97.62, 99.10, 94.09 |
Refinement procedure
| Resolution | 28.373 - 1.650 |
| R-factor | 0.1664 |
| Rwork | 0.165 |
| R-free | 0.20300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3hi5 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.876 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | PHENIX (dev_2363) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.680 |
| High resolution limit [Å] | 1.650 | 4.480 | 1.650 |
| Rmerge | 0.042 | 0.024 | 0.663 |
| Rmeas | 0.048 | 0.028 | 0.800 |
| Rpim | 0.024 | 0.014 | 0.441 |
| Total number of observations | 176673 | ||
| Number of reflections | 46314 | ||
| <I/σ(I)> | 13.1 | ||
| Completeness [%] | 95.1 | 98.6 | 69 |
| Redundancy | 3.8 | 3.9 | 2.9 |
| CC(1/2) | 0.999 | 0.693 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 294.15 | 25 % PEG2000MME, 100 mM Tris pH 7.0 |
