6C0Y
Lysinoalanine synthase, DurN, from duramycin biosynthesis bound to duramycin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-07-09 |
| Detector | RAYONIX MX-300 |
| Wavelength(s) | 0.97872 |
| Spacegroup name | P 1 |
| Unit cell lengths | 59.881, 67.423, 69.122 |
| Unit cell angles | 71.51, 76.25, 72.92 |
Refinement procedure
| Resolution | 64.720 - 1.660 |
| R-factor | 0.18719 |
| Rwork | 0.184 |
| R-free | 0.24231 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6c0h |
| RMSD bond length | 0.020 |
| RMSD bond angle | 2.119 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 64.720 | 1.687 |
| High resolution limit [Å] | 1.658 | 1.658 |
| Rmerge | 0.072 | 0.726 |
| Rmeas | 0.082 | 0.823 |
| Rpim | 0.039 | 0.387 |
| Number of reflections | 109913 | 5529 |
| <I/σ(I)> | 12 | 2.1 |
| Completeness [%] | 95.8 | 95.5 |
| Redundancy | 4.4 | 4.4 |
| CC(1/2) | 0.998 | 0.781 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 298 | 22.5% PEG 3350, 0.1 M MES pH 5.6 |
