3I72
Structural characterization for the nucleotide binding ability of subunit A with SO4 of the A1AO ATP synthase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13B1 |
Synchrotron site | NSRRC |
Beamline | BL13B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-04-09 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.00 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 128.248, 128.248, 104.676 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 24.910 - 2.470 |
R-factor | 0.219 |
Rwork | 0.217 |
R-free | 0.25300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1vdz |
RMSD bond length | 0.013 |
RMSD bond angle | 1.492 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.560 |
High resolution limit [Å] | 2.470 | 2.470 |
Rmerge | 0.057 | 0.464 |
Number of reflections | 31621 | |
<I/σ(I)> | 28.68 | 3.98 |
Completeness [%] | 99.6 | 99.7 |
Redundancy | 7 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 291 | 50% (v/v) MPD, 0.1 M acetate (pH 4.5), VAPOR DIFFUSION, HANGING DROP, temperature 291K |