4J1T
Crystal structure of Thermus thermophilus transhydrogenase heterotrimeric complex of the Alpha1 subunit dimer with the NADP binding domain (domain III) of the Beta subunit in P2(1)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL7-1 |
| Synchrotron site | SSRL |
| Beamline | BL7-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-12-02 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.18076 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 113.075, 68.866, 132.335 |
| Unit cell angles | 90.00, 91.03, 90.00 |
Refinement procedure
| Resolution | 132.350 - 2.370 |
| R-factor | 0.20719 |
| Rwork | 0.205 |
| R-free | 0.25298 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4j16 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.394 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 132.350 | 2.540 |
| High resolution limit [Å] | 2.370 | 2.370 |
| Rmerge | 0.050 | 0.366 |
| Number of reflections | 75579 | |
| <I/σ(I)> | 14.5 | 2.1 |
| Completeness [%] | 95.2 | 92 |
| Redundancy | 3.6 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 291 | Molecular Dimensions MD1-47 Morpheus kit, condition H2: 0.10 M amino acids, 0.1 M pH 6.5 buffers, 30.0% ethylene glycol + PEG8000, VAPOR DIFFUSION, SITTING DROP, temperature 291K |
