1S73
Crystal Structure of Mesopone Cytochrome c Peroxidase (R-isomer) [MpCcP-R]
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 115 |
Detector technology | IMAGE PLATE |
Collection date | 2002-09-11 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.54178 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 106.980, 76.149, 51.155 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.530 |
Rwork | 0.183 |
R-free | 0.20160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | WTCCP - ultra-high resolution structure |
RMSD bond length | 0.006 |
RMSD bond angle | 2.386 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.560 |
High resolution limit [Å] | 1.530 | 1.530 |
Rmerge | 0.050 | 0.171 |
Number of reflections | 62259 | |
<I/σ(I)> | 50 | 5.83 |
Completeness [%] | 97.2 | 73.8 |
Redundancy | 13.1 | 3.75 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 277 | tris-phosphate buffer, 2-methyl-2,4-pentanediol, pH 6, VAPOR DIFFUSION, SITTING DROP, temperature 277K |