3U1B
Crystal structure of the S238R mutant of mycrocine immunity protein (MccF) with AMP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-04-20 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9794 |
Spacegroup name | P 43 |
Unit cell lengths | 118.550, 118.550, 56.619 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 33.688 - 1.604 |
R-factor | 0.1651 |
Rwork | 0.164 |
R-free | 0.18980 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3gjz |
RMSD bond length | 0.015 |
RMSD bond angle | 1.607 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | MOLREP |
Refinement software | PHENIX ((phenix.refine: 1.7.1_743)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.000 | 1.630 |
High resolution limit [Å] | 1.604 | 1.604 |
Rmerge | 0.075 | |
Number of reflections | 101972 | |
<I/σ(I)> | 21 | |
Completeness [%] | 98.9 | 100 |
Redundancy | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291 | 30% Peg 3350, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 291K |