6SMP
AntDE:AntF (holo): type II PKS acyl-carrier protein in complex with its ketosynthase bound to the hexaketide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-10-15 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 108.300, 135.940, 148.600 |
| Unit cell angles | 90.00, 97.14, 90.00 |
Refinement procedure
| Resolution | 15.000 - 2.900 |
| R-factor | 0.2236 |
| Rwork | 0.222 |
| R-free | 0.25800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6smo |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.827 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.000 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmerge | 0.097 | 0.543 |
| Number of reflections | 92717 | 8962 |
| <I/σ(I)> | 11.4 | 2.4 |
| Completeness [%] | 97.9 | 98.4 |
| Redundancy | 3.1 | |
| CC(1/2) | 0.993 | 0.734 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 0.1 M BIS-TRIS, 0.5 M (NH4)2SO4, 30% PEG 3350 |
