2VHV
Crystal structure of the D270A mutant of L-alanine dehydrogenase from Mycobacterium tuberculosis in complex with NADH.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-1 |
Synchrotron site | ESRF |
Beamline | ID14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-09-28 |
Detector | ADSC CCD |
Spacegroup name | P 21 3 |
Unit cell lengths | 140.802, 140.802, 140.802 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.000 - 2.800 |
R-factor | 0.202 |
Rwork | 0.200 |
R-free | 0.24200 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.375 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.950 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.080 | 0.400 |
Number of reflections | 22947 | |
<I/σ(I)> | 12.9 | 4.1 |
Completeness [%] | 99.0 | 99 |
Redundancy | 4.4 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | 0.1M BIS TRIS PROPANE PH 8.2, 20% PEG 3350 AND 0.2M SODIUM ACETATE. CO CRYSTALLIZED WITH 10MM NADH WHICH WAS ADDED TO THE PROTEIN SOLUTION |