5MZX
Crystal structure of the decarboxylase AibA/AibB in complex with 4'-diphospho pantetheine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-02-14 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 66.546, 93.392, 90.044 |
| Unit cell angles | 90.00, 103.93, 90.00 |
Refinement procedure
| Resolution | 46.831 - 2.000 |
| R-factor | 0.166 |
| Rwork | 0.164 |
| R-free | 0.19650 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 5mzw |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.600 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.1.29) |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 46.831 | 46.830 | 2.040 |
| High resolution limit [Å] | 2.000 | 9.800 | 2.000 |
| Rmerge | 0.118 | 0.038 | 0.880 |
| Number of reflections | 72195 | ||
| <I/σ(I)> | 10.5 | ||
| Completeness [%] | 99.9 | 98.9 | 99.8 |
| Redundancy | 6.4 | 6.7 | 5.7 |
| CC(1/2) | 0.997 | 0.999 | 0.739 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.085 M sodium acetate, 0.17 M ammonium acetate, 15 % glycerol, 25 % PEG4000 |
