3EHF
Crystal structure of DesKC in complex with AMP-PCP
Experimental procedure
| Experimental method | SAD |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-11-16 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9793 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 75.800, 44.700, 131.450 |
| Unit cell angles | 90.00, 103.00, 90.00 |
Refinement procedure
| Resolution | 15.000 - 3.100 |
| R-factor | 0.245 |
| Rwork | 0.242 |
| R-free | 0.29700 |
| Structure solution method | SAD |
| RMSD bond length | 0.024 |
| RMSD bond angle | 1.654 |
| Data scaling software | XSCALE |
| Phasing software | SHARP |
| Refinement software | REFMAC (5.5.0053) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 26.700 | 3.200 | |
| High resolution limit [Å] | 3.100 | 20.000 | 3.100 |
| Rmerge | 0.110 | 0.058 | 0.444 |
| Number of reflections | 15927 | 67 | 1439 |
| <I/σ(I)> | 25.8 | 7.1 | |
| Completeness [%] | 99.1 | 90.5 | 99.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | PEG8000, MES, pH 6.5, vapor diffusion, hanging drop, temperature 291K |
