4ARM
Structure of the inactive pesticin T201A mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 65.623, 43.248, 133.201 |
Unit cell angles | 90.00, 99.36, 90.00 |
Refinement procedure
Resolution | 43.809 - 2.002 |
R-factor | 0.1786 |
Rwork | 0.176 |
R-free | 0.21280 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.004 |
RMSD bond angle | 0.826 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.000 | 2.120 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.090 | 0.420 |
Number of reflections | 50034 | |
<I/σ(I)> | 10.1 | 2.8 |
Completeness [%] | 99.2 | 98.7 |
Redundancy | 3.1 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | pH 7 |