1T87
Crystal Structure of the Ferrous CO-bound Cytochrome P450cam (C334A)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2003-06-06 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 67.030, 62.230, 94.920 |
Unit cell angles | 90.00, 90.48, 90.00 |
Refinement procedure
Resolution | 45.600 - 1.800 |
R-factor | 0.185 |
Rwork | 0.185 |
R-free | 0.20700 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.300 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.600 | 1.830 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.052 | 0.261 |
Number of reflections | 72208 | |
<I/σ(I)> | 30 | 4.4 |
Completeness [%] | 99.4 | 98.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.4 | 290 | PEG 4000, potassium chloride, Tris-HCl, D-camphor, pH 7.4, VAPOR DIFFUSION, SITTING DROP, temperature 290K |