1UTT
Crystal Structure of MMP-12 complexed to 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl-4-(4-ethoxy[1,1-biphenyl]-4-yl)-4-oxobutanoic acid
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 293 |
Detector technology | IMAGE PLATE |
Collection date | 2002-07-15 |
Detector | RIGAKU-MSC RAXIS IV++ |
Spacegroup name | P 41 3 2 |
Unit cell lengths | 125.041, 125.041, 125.041 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 2.200 |
Rwork | 0.217 |
R-free | 0.22900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1jk3 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.170 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | CNX (2001) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.068 | 0.406 |
Number of reflections | 17420 | |
<I/σ(I)> | 25.63 | 4.74 |
Completeness [%] | 99.2 | 99.8 |
Redundancy | 6.98 | 24 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 0.1M SODIUM CACODYLATE PH 6.4, 1.4M AMMONIUM ACETATE, 4 C |