6PBT
Pseudopaline Dehydrogenase with (R)-Pseudopaline Soaked 2 hours
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-02-11 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 181.619, 53.927, 96.895 |
Unit cell angles | 90.00, 98.82, 90.00 |
Refinement procedure
Resolution | 39.780 - 2.180 |
R-factor | 0.1755 |
Rwork | 0.173 |
R-free | 0.22600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6c4n |
RMSD bond length | 0.012 |
RMSD bond angle | 1.325 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.780 | 2.240 |
High resolution limit [Å] | 2.180 | 2.180 |
Number of reflections | 48010 | 3584 |
<I/σ(I)> | 11.5 | |
Completeness [%] | 97.8 | |
Redundancy | 6.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 270 mM ammonium formate, and 28% PEG 3350 |