5BN4
Structure of a unique ATP synthase NeqA-NeqB in complex with ANP from Nanoarcheaum equitans
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 | 2014-02-20 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9798 |
Spacegroup name | H 3 |
Unit cell lengths | 193.484, 193.484, 108.850 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 27.370 - 2.699 |
R-factor | 0.2177 |
Rwork | 0.215 |
R-free | 0.26170 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3gqb |
RMSD bond length | 0.002 |
RMSD bond angle | 0.632 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.680 |
High resolution limit [Å] | 2.630 | 2.630 |
Rmerge | 0.510 | |
Number of reflections | 39977 | |
<I/σ(I)> | 5.7 | 2.8 |
Completeness [%] | 99.8 | 97.3 |
Redundancy | 5.7 | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 280 | 0.1M MES, 1.6M Ammonium Sulphate |