4H0Y
Crystal structure of NAD+-Ia(E380S)-actin complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-5A |
Synchrotron site | Photon Factory |
Beamline | BL-5A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-05-29 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 53.869, 134.936, 154.336 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.910 - 1.940 |
R-factor | 0.22032 |
Rwork | 0.220 |
R-free | 0.23309 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4h03 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.625 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP (11.0) |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.970 |
High resolution limit [Å] | 1.940 | 1.940 |
Rmerge | 0.073 | 0.353 |
Number of reflections | 83852 | |
<I/σ(I)> | 13.6 | 4.9 |
Completeness [%] | 99.9 | 99.5 |
Redundancy | 6.5 | 5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277.13 | 18% PEG1500, 0.1M MES, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277.13K |