3L7Q
Crystal structure of AldR from streptococcus mutans
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-002 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-07-20 |
Detector | RIGAKU SATURN 944 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 171.124, 78.182, 102.488 |
Unit cell angles | 90.00, 121.28, 90.00 |
Refinement procedure
Resolution | 41.370 - 2.500 |
R-factor | 0.21651 |
Rwork | 0.215 |
R-free | 0.24974 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1qd9 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.367 |
Data reduction software | CrystalClear |
Data scaling software | CrystalClear |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Number of reflections | 40167 | |
Completeness [%] | 99.9 | 99 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 0.2M MgCl2, 0.1M Tris-HCl pH8.5, 25.0% PEG3350, VAPOR DIFFUSION, SITTING DROP |