1N4V
ATOMIC RESOLUTION STRUCTURE OF CHOLESTEROL OXIDASE @pH 5.8 (STREPTOMYCES SP. SA-COO)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X8C |
Synchrotron site | NSLS |
Beamline | X8C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 1999-04-23 |
Detector | ADSC QUANTUM 4 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 51.354, 73.291, 63.171 |
Unit cell angles | 90.00, 105.10, 90.00 |
Refinement procedure
Resolution | 46.900 - 1.000 |
Rwork | 0.119 |
R-free | 0.14680 |
Structure solution method | AB INITIO PHASING |
Starting model (for MR) | 1mxt |
RMSD bond length | 0.015 |
RMSD bond angle | 0.030 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHELX |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.900 | 1.020 |
High resolution limit [Å] | 1.000 | 1.000 |
Rmerge | 0.069 | 0.656 |
Number of reflections | 230865 | |
<I/σ(I)> | 7.2 | 1.7 |
Completeness [%] | 95.0 | 90.8 |
Redundancy | 4.1 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.8 | PEG 8000, MANGANESE SULFATE, CACODYLATE, pH 5.8 |