5G62
S.pneumoniae ABC-transporter substrate binding protein FusA EF-hand mutant in complex with fructo-nystose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-04-23 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 122.580, 122.580, 169.470 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 77.169 - 1.990 |
| R-factor | 0.1728 |
| Rwork | 0.171 |
| R-free | 0.20800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5g5y |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.202 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 86.860 | 2.040 |
| High resolution limit [Å] | 1.990 | 1.990 |
| Rmerge | 0.200 | 1.500 |
| Number of reflections | 88883 | |
| <I/σ(I)> | 12.2 | 1.5 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 14.7 | 14.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 20 % PEG6000, 0.1M SODIUM ACETATE PH 5.0, 0.02 M CALCIUM CHLORIDE |
