3Q1P
Crystal structure of CDP-Chase
Experimental procedure
| Experimental method | SAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 31-ID |
| Synchrotron site | APS |
| Beamline | 31-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-12-08 |
| Detector | RAYONIX MX225HE |
| Wavelength(s) | 0.97989 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 60.471, 71.426, 111.217 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.800 |
| R-factor | 0.1965 |
| Rwork | 0.194 |
| R-free | 0.23820 |
| Structure solution method | SAD |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.107 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.860 |
| High resolution limit [Å] | 1.800 | 3.880 | 1.800 |
| Rmerge | 0.078 | 0.058 | 0.561 |
| Number of reflections | 45135 | ||
| <I/σ(I)> | 8.6 | ||
| Completeness [%] | 99.9 | 99.6 | 99.5 |
| Redundancy | 14.2 | 14 | 12.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | 0.1 M Tris-HCl pH 8.5, 0.2 to 0.3 M Lithium sulfate, 26 to 29% PEG-4000, vapor diffusion, hanging drop, temperature 298K, VAPOR DIFFUSION, HANGING DROP |
