4PAG
ABC transporter solute binding protein from Sulfurospirillum deleyianum DSM 6946
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-07-29 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97915 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 83.055, 50.813, 91.544 |
Unit cell angles | 90.00, 98.00, 90.00 |
Refinement procedure
Resolution | 40.210 - 1.901 |
R-factor | 0.1445 |
Rwork | 0.141 |
R-free | 0.20230 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.199 |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.930 |
High resolution limit [Å] | 1.900 | 5.160 | 1.900 |
Rmerge | 0.119 | 0.058 | 0.960 |
Total number of observations | 426232 | ||
Number of reflections | 59880 | ||
<I/σ(I)> | 6.8 | ||
Completeness [%] | 99.9 | 99.1 | 99.9 |
Redundancy | 7.1 | 6.9 | 6.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 297 | magnesiun chloride, MES, PEG4000 |