6MAV
Complex of tissue inhibitor of metalloproteinase-1 (TIMP-1) mutant L34G with matrix metalloproteinase-3 catalytic domain (MMP-3cd)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 80 |
Detector technology | CCD |
Collection date | 2017-11-16 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 69.703, 69.703, 321.326 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 52.588 - 2.370 |
R-factor | 0.2211 |
Rwork | 0.217 |
R-free | 0.29780 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1uea |
RMSD bond length | 0.010 |
RMSD bond angle | 1.349 |
Data reduction software | xia2 |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.590 | 2.490 |
High resolution limit [Å] | 2.370 | 2.370 |
Rmerge | 0.066 | 0.791 |
Rmeas | 0.069 | |
Number of reflections | 19911 | 1928 |
<I/σ(I)> | 19.1 | 3.09 |
Completeness [%] | 99.9 | 100 |
Redundancy | 12.1 | 12.7 |
CC(1/2) | 0.999 | 0.933 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 298 | 0.1 M Ammonium Acetate 0.1 M Bis-Tris: HCl, pH 5.5, 17 % (w/v) PEG 10,000 |