3L4S
Crystal structure of C151G mutant of Glyceraldehyde 3-phosphate dehydrogenase 1 (GAPDH1) from methicillin resistant Staphylococcus aureus MRSA252 complexed with NAD and G3P
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2009-10-10 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 68.593, 102.936, 90.652 |
Unit cell angles | 90.00, 109.31, 90.00 |
Refinement procedure
Resolution | 27.760 - 2.200 |
R-factor | 0.19961 |
Rwork | 0.197 |
R-free | 0.24877 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3H48 |
RMSD bond length | 0.017 |
RMSD bond angle | 1.699 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0095) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 85.550 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.083 | 0.400 |
Number of reflections | 57048 | |
<I/σ(I)> | 8.3 | 2.5 |
Completeness [%] | 94.9 | 98.6 |
Redundancy | 3.63 | 3.47 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | 0.1 (M) Tris-HCl, pH8.5, 30% PEG 4000, VAPOR DIFFUSION, HANGING DROP, temperature 298K |