3ASD
MamA R50E mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-11-14 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.972 |
Spacegroup name | P 43 2 2 |
Unit cell lengths | 43.649, 43.649, 207.449 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.710 - 2.450 |
R-factor | 0.2745 |
Rwork | 0.272 |
R-free | 0.32500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3as5 |
RMSD bond length | 0.020 |
RMSD bond angle | 1.851 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.490 |
High resolution limit [Å] | 2.450 | 6.650 | 2.450 |
Rmerge | 0.048 | 0.031 | 0.285 |
Number of reflections | 8008 | ||
<I/σ(I)> | 23.4 | ||
Completeness [%] | 98.0 | 80 | 100 |
Redundancy | 10 | 7.1 | 10.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 286 | MES, NaCl, pH 6, VAPOR DIFFUSION, SITTING DROP, temperature 286K |