1A7Y
CRYSTAL STRUCTURE OF ACTINOMYCIN D
Experimental procedure
Source type | ROTATING ANODE |
Source details | SIEMENS |
Temperature [K] | 133 |
Detector technology | AREA DETECTOR |
Collection date | 1997-11-03 |
Detector | SIEMENS HI-STAR |
Spacegroup name | P 1 |
Unit cell lengths | 15.737, 15.887, 25.156 |
Unit cell angles | 85.93, 86.19, 69.86 |
Refinement procedure
Resolution | ? - 0.940 |
R-factor | 0.058 |
R-free | 0.06800 |
Structure solution method | AB INITIO |
RMSD bond length | 0.000 |
RMSD bond angle | 0.000 |
Data reduction software | SAINT |
Data scaling software | SADABS |
Phasing software | SHELXL-97 |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 999.000 | 1.050 |
High resolution limit [Å] | 0.940 | 0.940 |
Rmerge | 0.044 | 0.072 |
Total number of observations | 95014 * | |
Number of reflections | 14126 | |
<I/σ(I)> | 25.9 | 11.9 |
Completeness [%] | 95.1 | 90.5 |
Redundancy | 4.38 | 2.85 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | unknown * | 5 | PH 5.0 |