1YOU
Crystal structure of the catalytic domain of MMP-13 complexed with a potent pyrimidinetrione inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 81.089, 108.223, 36.035 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.900 - 2.300 |
R-factor | 0.21507 |
Rwork | 0.208 |
R-free | 0.29459 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 830c |
RMSD bond length | 0.022 |
RMSD bond angle | 2.064 |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 20.000 |
High resolution limit [Å] | 2.060 |
Number of reflections | 15989 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | VAPOR DIFFUSION, HANGING DROP |