7QX0
Transaminase Structure of Plurienzyme (Tr2E2) in complex with PLP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1) |
| Synchrotron site | PETRA III, EMBL c/o DESY |
| Beamline | P13 (MX1) |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-05-05 |
| Detector | DECTRIS EIGER R 4M |
| Wavelength(s) | 0.976200 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 99.921, 107.627, 211.637 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.620 - 3.500 |
| Rwork | 0.200 |
| R-free | 0.28800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | own model |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.198 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.17) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.620 | 3.625 |
| High resolution limit [Å] | 3.500 | 3.500 |
| Number of reflections | 29483 | 2892 |
| <I/σ(I)> | 15.4 | |
| Completeness [%] | 99.8 | 99.93 |
| Redundancy | 6.4 | |
| CC(1/2) | 1.000 | 0.978 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 289 | Tf 4% (w/v) PEG 6000 100 mM citric acid pH 4 |
