1VGF
volvatoxin A2 (diamond crystal form)
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL38B1 |
Synchrotron site | SPring-8 |
Beamline | BL38B1 |
Temperature [K] | 133 |
Detector technology | CCD |
Collection date | 2001-04-18 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.92040, 0.9201, 0.9199, 0.9070 |
Spacegroup name | P 41 2 2 |
Unit cell lengths | 56.310, 56.310, 264.919 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.540 - 2.600 |
Rwork | 0.214 |
R-free | 0.26800 |
Structure solution method | MAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.300 |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.540 | 2.690 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.049 | 0.303 |
Number of reflections | 14033 | |
<I/σ(I)> | 12.5 | 10.33 |
Completeness [%] | 99.6 | 99.9 |
Redundancy | 34.87 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | ammonium sulfate, PEG 4000, glycerol, VAPOR DIFFUSION, HANGING DROP, temperature 298K |