3PGU
Phe3Glu mutant of EcFadL
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X6A |
| Synchrotron site | NSLS |
| Beamline | X6A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-04-26 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.10000 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 65.200, 65.200, 280.280 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 42.506 - 1.700 |
| R-factor | 0.1679 |
| Rwork | 0.168 |
| R-free | 0.18020 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1t16 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.085 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: dev_572)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.000 | 1.790 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.118 | 0.461 |
| Number of reflections | 92723 | |
| <I/σ(I)> | 7.6 | 4.4 |
| Completeness [%] | 86.6 | 97.1 |
| Redundancy | 5.2 | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 295 | 15mM tricine pH 8.5 24% w/v PEG 4000, prior to setup, protein dialyzed in Tris, NaCl pH8 C8E4, VAPOR DIFFUSION, HANGING DROP, temperature 295K |
