4A3Y
Crystal structure of Raucaffricine glucosidase from ajmaline biosynthesis pathway
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X11 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X11 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-05-18 |
Detector | MAR555 FLAT PANEL |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 102.774, 127.329, 215.837 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.990 - 2.150 |
R-factor | 0.16593 |
Rwork | 0.165 |
R-free | 0.20355 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2jf7 |
RMSD bond length | 0.023 |
RMSD bond angle | 1.689 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | Auto-Rickshaw |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.300 |
High resolution limit [Å] | 2.150 | 2.150 |
Rmerge | 0.120 | 0.690 |
Number of reflections | 76299 | |
<I/σ(I)> | 24.6 | 4.4 |
Completeness [%] | 99.3 | 98.8 |
Redundancy | 15.3 | 15 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 0.01 TO 0.3 M AMMONIUM SULFATE, 0.1 M SODIUM ACETATE, PH 4.5 TO 5.0, 9 TO 12% (W/V) PEG 4000 |