4QWW
Crystal structure of the Fab410-BfAChE complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-10-04 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.979 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 156.592, 251.336, 73.978 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.530 - 2.700 |
R-factor | 0.2009 |
Rwork | 0.199 |
R-free | 0.23880 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB ENTRIES 1J06 & 1IQW |
RMSD bond length | 0.010 |
RMSD bond angle | 1.200 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | BUSTER (2.11.5) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 78.000 | 2.850 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.594 | |
Number of reflections | 81126 | |
<I/σ(I)> | 10.2 | 2 |
Completeness [%] | 99.9 | 99.4 |
Redundancy | 4.4 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 7.0-12.5% PEG8000, 0.2 M sodium citrate, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |