8AJX
E. coli NfsA with Fumarate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-09-28 |
| Detector | RIGAKU SATURN 70 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 92.061, 52.237, 64.957 |
| Unit cell angles | 90.00, 134.17, 90.00 |
Refinement procedure
| Resolution | 46.590 - 1.250 |
| R-factor | 0.1075 |
| Rwork | 0.106 |
| R-free | 0.13250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1f5v |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.283 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.600 | 1.280 |
| High resolution limit [Å] | 1.247 | 1.247 |
| Number of reflections | 57570 | 2626 |
| <I/σ(I)> | 26.1 | 3.7 |
| Completeness [%] | 93.5 | 61.16 |
| Redundancy | 8.69 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291 | 100 mM imidazole pH 7, 26 % PEG 3,000 30 mM Fumarate |
