5T3N
Sp-2Cl-cAMPS bound to PKAR CBD2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-06-25 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 64.190, 64.190, 195.710 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.420 - 2.400 |
| R-factor | 0.254 |
| Rwork | 0.251 |
| R-free | 0.30700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5k8s |
| RMSD bond length | 0.013 |
| RMSD bond angle | 2.179 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.8.4_1496) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.300 | 2.530 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.038 | 0.316 |
| Number of reflections | 16863 | |
| <I/σ(I)> | 11.2 | 2.2 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 11.2 | 11.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 295 | 20% w/v Polethylene glycol 3350, 0.2M NH4I |
