3DNF
Structure of (E)-4-Hydroxy-3-methyl-but-2-enyl Diphosphate Reductase, the Terminal Enzyme of the Non-Mevalonate Pathway
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-07-01 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.983 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 60.370, 87.760, 72.400 |
Unit cell angles | 90.00, 95.13, 90.00 |
Refinement procedure
Resolution | 9.900 - 1.650 |
R-factor | 0.19429 |
Rwork | 0.193 |
R-free | 0.22605 |
Structure solution method | MAD |
RMSD bond length | 0.017 |
RMSD bond angle | 1.455 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | SHARP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 9.900 | 1.700 |
High resolution limit [Å] | 1.650 | 1.650 |
Number of reflections | 78765 | |
<I/σ(I)> | 15.94 | 3.29 |
Completeness [%] | 87.2 | 53.4 |
Redundancy | 3.571 | 2.356 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 291 | 10 % (w/w) PEG 8000, 0,1 M Tris-HCl, VAPOR DIFFUSION, HANGING DROP, temperature 291K |