4CDZ
Crystal Structure of Spinosyn Rhamnosyl 4'-O-Methyltransferase SpnH from Saccharopolyspora spinosa
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13B1 |
Synchrotron site | NSRRC |
Beamline | BL13B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-07-31 |
Detector | ADSC QUANTUM 315r |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 54.773, 54.773, 307.937 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 34.835 - 2.503 |
R-factor | 0.2145 |
Rwork | 0.208 |
R-free | 0.26940 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2wk1 |
RMSD bond length | 0.004 |
RMSD bond angle | 0.886 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHENIX |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.840 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.110 | 0.670 |
Number of reflections | 10187 | |
<I/σ(I)> | 25.7 | 3.1 |
Completeness [%] | 98.5 | 99.7 |
Redundancy | 16.4 | 16.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | 8% (W/V) POLYETHYLENE GLYCOL 8000, 100MM SODIUM CACODYLATE, PH6, 100MM MAGNESIUM ACETATE |