6HV2
MMP-13 in complex with the peptide IMISF
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-11-14 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.99987 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 68.928, 68.928, 133.563 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 34.460 - 1.709 |
R-factor | 0.2163 |
Rwork | 0.214 |
R-free | 0.26300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2ow9 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.649 |
Data reduction software | XDS (VERSION May 1, 2016 BUILT=20160617) |
Data scaling software | XDS (VERSION May 1, 2016 BUILT=20160617) |
Phasing software | MOLREP (Vers 11.4.06) |
Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.460 | 1.770 |
High resolution limit [Å] | 1.709 | 1.709 |
Rmerge | 0.211 | |
Rmeas | 0.214 | |
Number of reflections | 21019 | 2003 |
<I/σ(I)> | 18.59 | 1.31 |
Completeness [%] | 99.7 | 97.85 |
Redundancy | 37.3 | 36.5 |
CC(1/2) | 1.000 | 0.634 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | 50 mM glycine, 20% PEG4000, 1 M ammonium formate, pH 9.4 |