3GA0
CtBP1/BARS Gly172->Glu mutant structure: impairing NAD(H) binding and dimerization
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-3 |
Synchrotron site | ESRF |
Beamline | ID14-3 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-12-16 |
Spacegroup name | P 64 2 2 |
Unit cell lengths | 89.197, 89.197, 160.259 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 29.750 - 3.400 |
R-factor | 0.26974 |
Rwork | 0.262 |
R-free | 0.33367 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1hku |
RMSD bond length | 0.008 |
RMSD bond angle | 1.142 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.800 | 3.500 |
High resolution limit [Å] | 3.400 | 3.400 |
Number of reflections | 5615 | |
Completeness [%] | 99.5 | 98.9 |
Redundancy | 4.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 294 | 1.8-2.1M Ammonium formate, 1.0M Hepes (pH7.5), cross-seeding technique, VAPOR DIFFUSION, temperature 294K |