1U31
recombinant human heart transhydrogenase dIII bound with NADPH
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-1 |
Synchrotron site | ESRF |
Beamline | ID14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.934 |
Spacegroup name | P 41 2 2 |
Unit cell lengths | 57.814, 57.814, 250.934 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 31.700 - 2.200 |
R-factor | 0.23164 |
Rwork | 0.230 |
R-free | 0.26841 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1djl |
RMSD bond length | 0.006 |
RMSD bond angle | 0.966 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 63.000 |
High resolution limit [Å] | 2.200 |
Number of reflections | 19463 |
Completeness [%] | 82.4 |
Redundancy | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 281 | ammonium sulphate, MES, dioxane, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 281K |