6AHS
Mouse Kallikrein 7 in complex with imidazolinylindole derivative
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2012-07-10 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 71.156, 71.156, 98.907 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.290 - 1.750 |
R-factor | 0.16943 |
Rwork | 0.167 |
R-free | 0.21177 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5zfh |
RMSD bond length | 0.020 |
RMSD bond angle | 1.591 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | AMoRE |
Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 1.780 |
High resolution limit [Å] | 1.750 | 1.750 |
Number of reflections | 26249 | |
<I/σ(I)> | 17.6 | |
Completeness [%] | 99.1 | |
Redundancy | 13.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | PEG 8000, PEG 400, magnesium chloride, Tris/HCl |