6QPP
Rhizomucor miehei lipase propeptide complex, native
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-06-22 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.98 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 98.040, 61.020, 62.650 |
Unit cell angles | 90.00, 111.97, 90.00 |
Refinement procedure
Resolution | 50.700 - 1.490 |
R-factor | 0.13978 |
Rwork | 0.138 |
R-free | 0.17815 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3tgl |
RMSD bond length | 0.017 |
RMSD bond angle | 1.850 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.700 | 1.530 |
High resolution limit [Å] | 1.490 | 1.490 |
Rmerge | 0.064 | 0.270 |
Rmeas | 0.085 | 0.364 |
Number of reflections | 55513 | 368 |
<I/σ(I)> | 9.8 | 3.8 |
Completeness [%] | 99.2 | 99.1 |
Redundancy | 3.6 | 3.6 |
CC(1/2) | 0.996 | 0.893 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | PEG8K, sodium cacodylate, ammonium sulphate |