3ASH
MamA D159K mutant 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-05-13 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.979 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 74.143, 77.477, 101.811 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.670 - 2.410 |
R-factor | 0.1851 |
Rwork | 0.183 |
R-free | 0.21530 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3as5 |
RMSD bond length | 0.025 |
RMSD bond angle | 1.832 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 40.000 | 40.000 | 2.440 |
High resolution limit [Å] | 2.400 | 6.510 | 2.400 |
Rmerge | 0.083 | 0.050 | 0.468 |
Number of reflections | 22006 | ||
<I/σ(I)> | 12.1 | ||
Completeness [%] | 94.8 | 96.4 | 100 |
Redundancy | 8.1 | 7.1 | 8.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 286 | Ammonium sulfate, Glycerol, Tris, NaCl, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 286K |