8I5Z
LDH Mutant P101Q-(An unexpected single-point mutation triggers the unleashing of catalytic potential of a NADH-dependent dehydrogenase)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-06-19 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97918 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 92.302, 92.302, 380.013 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.640 - 2.650 |
R-factor | 0.2448 |
Rwork | 0.241 |
R-free | 0.31050 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.076 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.640 |
High resolution limit [Å] | 2.600 | 2.600 |
Number of reflections | 55587 | 2688 |
<I/σ(I)> | 13.8 | |
Completeness [%] | 98.5 | |
Redundancy | 16.1 | |
CC(1/2) | 0.941 | 0.793 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | 0.2 M Ammonium Acetate 0.1 M Bis-tris (pH5.7) 47% (V/V) 2-Methyl-2,4-pentanediol |