1SQQ
Crystal Structure Analysis of Bovine Bc1 with Methoxy Acrylate Stilbene (MOAS)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X9B |
Synchrotron site | NSLS |
Beamline | X9B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2001-01-21 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.736 |
Spacegroup name | I 41 2 2 |
Unit cell lengths | 153.677, 153.677, 598.824 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 3.000 |
R-factor | 0.2302 |
Rwork | 0.228 |
R-free | 0.29485 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1qcr |
RMSD bond length | 0.023 |
RMSD bond angle | 1.851 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.080 |
High resolution limit [Å] | 3.000 | 3.000 |
Number of reflections | 67802 | |
Completeness [%] | 90.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.2 | 277 | 20mM ammonium acetate, 20% glycerol, 12% PEG4000, 0.5M KCl, 0.1% diheptanoyl-phosphatidylcholine , pH 7.2, VAPOR DIFFUSION, temperature 277K |