6RTS
Piperideine-6-carboxylate dehydrogenase from Streptomyces clavuligerus complexed with NAD+
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-03-07 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.8726 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 111.040, 131.240, 157.710 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.400 - 2.250 |
| R-factor | 0.16752 |
| Rwork | 0.166 |
| R-free | 0.20467 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6rtr |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.470 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0107) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.400 | 2.310 |
| High resolution limit [Å] | 2.250 | 2.250 |
| Rmeas | 0.159 | 0.663 |
| Number of reflections | 54522 | 5800 |
| <I/σ(I)> | 8.32 | 2.22 |
| Completeness [%] | 99.4 | 99.8 |
| Redundancy | 3.7 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 0,1 M sodium acetate pH 5, 2.2 M ammonium sulphate, 0.2 M lithium acetate |
