3ZHR
Crystal structure of the H747A mutant of the SucA domain of Mycobacterium smegmatis KGD showing the active site lid closed
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-03-18 |
Detector | ADSC CCD |
Spacegroup name | P 1 |
Unit cell lengths | 79.970, 83.450, 159.670 |
Unit cell angles | 99.64, 98.82, 100.98 |
Refinement procedure
Resolution | 30.750 - 2.100 |
R-factor | 0.1812 |
Rwork | 0.180 |
R-free | 0.20200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2yic |
RMSD bond length | 0.010 |
RMSD bond angle | 0.990 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | BUSTER (2.11.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.750 | 2.210 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.100 | 0.740 |
Number of reflections | 221700 | |
<I/σ(I)> | 10.7 | 1.9 |
Completeness [%] | 96.6 | 92.1 |
Redundancy | 3.9 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.6 | 52% MPD, 20 MM NA ACETATE, pH 7.6 |