7KW0
Non-ribosomal didomain (stabilised glycine-PCP-C) acceptor bound state
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX1 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2019-09-28 |
| Detector | DECTRIS EIGER2 X 9M |
| Wavelength(s) | 0.95372 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 105.300, 105.508, 107.917 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.040 - 1.900 |
| R-factor | 0.1931 |
| Rwork | 0.192 |
| R-free | 0.21690 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | model from SAD |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.641 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.040 | 1.930 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Number of reflections | 95246 | 4669 |
| <I/σ(I)> | 13.3 | 1.2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 6.8 | 6.9 |
| CC(1/2) | 0.996 | 0.497 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.4 | 293 | PEG 3350, Magnesium formate |
