5I0Y
COPPER-BOUND E46Q VARIANT OF UROPATHOGENIC ESCHERICHIA COLI STRAIN F11 FETP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL7-1 |
| Synchrotron site | SSRL |
| Beamline | BL7-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-05-07 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 83.160, 36.540, 101.000 |
| Unit cell angles | 90.00, 106.52, 90.00 |
Refinement procedure
| Resolution | 33.650 - 1.400 |
| R-factor | 0.19 |
| Rwork | 0.188 |
| R-free | 0.21400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3nrq |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.310 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.650 | 1.470 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Number of reflections | 50962 | |
| <I/σ(I)> | 14.9 | 5 |
| Completeness [%] | 87.4 | 84.8 |
| Redundancy | 3.9 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 295 | 20% PEG 550, 100 MM BIS-TRIS PH 6.5, 40 MM CACL2 |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 295 | 20% PEG 550, 100 MM BIS-TRIS PH 6.5, 40 MM CACL2 |
