1NS5
X-RAY STRUCTURE OF YBEA FROM E.COLI. NORTHEAST STRUCTURAL GENOMICS RESEARCH CONSORTIUM (NESG) TARGET ER45
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X12C |
| Synchrotron site | NSLS |
| Beamline | X12C |
| Temperature [K] | 90 |
| Detector technology | CCD |
| Collection date | 2002-11-22 |
| Detector | BRANDEIS - B4 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 44.922, 58.652, 57.415 |
| Unit cell angles | 90.00, 102.15, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.680 |
| R-factor | 0.145 |
| Rwork | 0.145 |
| R-free | 0.21300 |
| Structure solution method | MAD |
| RMSD bond length | 0.023 |
| RMSD bond angle | 1.905 |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.730 |
| High resolution limit [Å] | 1.680 | 1.680 |
| Rmerge | 0.114 | 0.114 |
| Number of reflections | 33226 | |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 7.58 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 20% PEG 3350, 0.2M LICL2 |
