3T66
Crystal structure of Nickel ABC transporter from Bacillus halodurans
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-07-21 |
Detector | ADSC QUANTUM 315 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 124.047, 147.127, 75.066 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.980 - 2.800 |
R-factor | 0.222 |
Rwork | 0.219 |
R-free | 0.27400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3rqt |
RMSD bond length | 0.019 |
RMSD bond angle | 1.863 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.900 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.080 | 0.428 |
Number of reflections | 16232 | |
<I/σ(I)> | 11.4 | 5 |
Completeness [%] | 99.9 | 99.3 |
Redundancy | 19.6 | 19.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 298 | 0.2M CaCl2,0.1M HEPES, 28%PEG 400, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |