3DOC
Crystal Structure of TrkA glyceraldehyde-3-phosphate dehydrogenase from Brucella melitensis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 5.0.1 |
| Synchrotron site | ALS |
| Beamline | 5.0.1 |
| Temperature [K] | 100 |
| Wavelength(s) | 0.9774 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 71.975, 106.333, 90.776 |
| Unit cell angles | 90.00, 107.89, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.400 |
| R-factor | 0.187 |
| Rwork | 0.185 |
| R-free | 0.22500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1obf |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.467 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (refmac_5.4.0067) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.490 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.150 | 0.444 |
| Number of reflections | 49106 | |
| <I/σ(I)> | 11.6 | 2.4 |
| Completeness [%] | 97.8 | 98.4 |
| Redundancy | 3.5 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.9 | 289 | JCSG+ screen well B2, 20% PEG 3350, 0.2 M sodium isothiocyanate, , pH 6.9, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
