3DNT
structures of MDT proteins
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.3.1 |
Synchrotron site | ALS |
Beamline | 8.3.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-12-23 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.989 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 68.540, 84.090, 69.250 |
Unit cell angles | 90.00, 91.56, 90.00 |
Refinement procedure
Resolution | 42.580 - 1.660 |
R-factor | 0.184 |
Rwork | 0.184 |
R-free | 0.21700 |
Structure solution method | MAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.400 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | CNS |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.600 | 1.760 |
High resolution limit [Å] | 1.660 | 1.660 |
Rmerge | 0.055 | 0.290 |
Number of reflections | 89050 | |
<I/σ(I)> | 10.5 | 3.2 |
Completeness [%] | 96.0 | 0.98 |
Redundancy | 4 | 425 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9.5 | 298 | PEG 600, pH 9.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |