2W2L
Crystal structure of the holo forms of Rhodotorula graminis D- mandelate dehydrogenase at 2.5A.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 77 |
Detector technology | CCD |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 100.098, 110.154, 79.836 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.280 - 2.500 |
R-factor | 0.186 |
Rwork | 0.182 |
R-free | 0.26500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1mx3 |
RMSD bond length | 0.018 |
RMSD bond angle | 1.855 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.280 | 2.640 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.150 | 0.530 |
Number of reflections | 59123 | |
<I/σ(I)> | 11.4 | 3.7 |
Completeness [%] | 98.8 | 98.5 |
Redundancy | 4.7 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 100 MM POTASSIUM PHOSPHATE PH 6.0, 42% SATURATED AMMONIUM SULPHATE |