2BOV
Molecular recognition of an ADP-ribosylating Clostridium botulinum C3 exoenzyme by RalA GTPase
Replaces: 1WCAExperimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX9.6 |
Synchrotron site | SRS |
Beamline | PX9.6 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-02-22 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 56.629, 90.836, 100.400 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.660 |
R-factor | 0.206 |
Rwork | 0.206 |
R-free | 0.27400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1G24 AND 1UAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.100 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.760 |
High resolution limit [Å] | 2.660 | 2.660 |
Rmerge | 0.110 | 0.260 |
Number of reflections | 15556 | |
<I/σ(I)> | 14.6 | 5.8 |
Completeness [%] | 99.8 | 99.9 |
Redundancy | 15.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.3 | 0.1M HEPES PH 7.3 12-15% ETHYLENE GLYCOL 14-18% PEG 8000 |