5BQ3
Crystal structure of a sugar ABC transporter (ACTODO_00688) from Actinomyces odontolyticus ATCC 17982 at 2.60 A resolution
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-01-16 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9116,0.9796 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 84.780, 83.280, 104.220 |
| Unit cell angles | 90.00, 111.87, 90.00 |
Refinement procedure
| Resolution | 19.936 - 2.600 |
| R-factor | 0.2076 |
| Rwork | 0.207 |
| R-free | 0.21860 |
| Structure solution method | MAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.970 |
| Data reduction software | XDS |
| Data scaling software | XSCALE (November 3, 2014 BUILT=20141118) |
| Phasing software | SHELX |
| Refinement software | BUSTER (2.10.2) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 19.936 | 19.936 | 2.670 |
| High resolution limit [Å] | 2.600 | 11.630 | 2.600 |
| Rmerge | 0.097 | 0.029 | 0.927 |
| Rmeas | 0.137 | 0.040 | 1.306 |
| Total number of observations | 117477 | ||
| Number of reflections | 40255 | 658 | 5782 |
| <I/σ(I)> | 6.47 | 21.2 | 1 |
| Completeness [%] | 92.8 | 72.3 | 94.7 |
| Redundancy | 1.553 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.2M ammonium sulfate, 20% polyethylene glycol 3350 |
