2GWL
Crystal structure of the Salmonella SpvB ATR Domain in complex with NADH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X9A |
| Synchrotron site | NSLS |
| Beamline | X9A |
| Collection date | 2003-11-17 |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 55.585, 55.585, 143.577 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 30.000 - 1.900 |
| R-factor | 0.195 |
| Rwork | 0.194 |
| R-free | 0.23500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.021 |
| RMSD bond angle | 1.865 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 30.000 | 30.000 | 1.970 |
| High resolution limit [Å] | 1.900 | 4.090 | 1.900 |
| Rmerge | 0.040 | 0.023 | 0.367 |
| Number of reflections | 21074 | ||
| <I/σ(I)> | 20.6 | ||
| Completeness [%] | 99.7 | 97.2 | 100 |
| Redundancy | 5.4 | 4.9 | 5.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
