8C5P
E. coli NfsB mutant N71S T41L with acetate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-07-17 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.9334 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 57.223, 57.223, 262.944 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.160 - 1.690 |
| R-factor | 0.15189 |
| Rwork | 0.150 |
| R-free | 0.18793 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.818 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.920 | 1.800 |
| High resolution limit [Å] | 1.690 | 1.690 |
| Number of reflections | 49521 | 3178 |
| <I/σ(I)> | 36.9 | |
| Completeness [%] | 99.0 | |
| Redundancy | 13 | 3.54 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 291 | 10-18% PEG 4000, 50-200 mM sodium acetate buffer pH 4.6, 15% ethylene glycol. |
