3RD4
Crystal structure of PROPEN_03304 from Proteus penneri ATCC 35198 Northeast Structural Genomics Consortium target id PvR55
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4A |
| Synchrotron site | NSLS |
| Beamline | X4A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-03-10 |
| Detector | ADSC QUANTUM 4r |
| Wavelength(s) | 0.707 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 138.415, 91.365, 52.198 |
| Unit cell angles | 90.00, 104.97, 90.00 |
Refinement procedure
| Resolution | 40.060 - 2.900 |
| R-factor | 0.211 |
| Rwork | 0.211 |
| R-free | 0.25000 |
| Structure solution method | SAD |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.500 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | CNS (1.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.000 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmerge | 0.088 | |
| Number of reflections | 26654 | |
| <I/σ(I)> | 9.9 | |
| Completeness [%] | 95.7 | 73.7 |
| Redundancy | 3.7 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291 | 0.1M HEPES (pH 7.5), 30% PEG8k, and 0.1M, NaCl , VAPOR DIFFUSION, SITTING DROP, temperature 18K, temperature 291K |
