2WNL
CRYSTAL STRUCTURE OF APLYSIA ACHBP IN COMPLEX WITH ANABASEINE
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-04-05 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 84.251, 125.768, 257.001 |
Unit cell angles | 90.00, 95.40, 90.00 |
Refinement procedure
Resolution | 258.200 - 2.700 |
R-factor | 0.20327 |
Rwork | 0.202 |
R-free | 0.25059 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2byn |
RMSD bond length | 0.007 |
RMSD bond angle | 1.108 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 70.000 | 2.850 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.100 | 0.490 |
Number of reflections | 73265 | |
<I/σ(I)> | 9.8 | 2.4 |
Completeness [%] | 99.6 | 100 |
Redundancy | 3.4 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 19% PEG4000, 95 MM NA-CITRATE, PH 5.6, 19% ISOPROPANOL, 5% GLYCEROL |