3NER
Structure of Human Type B Cytochrome b5
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE F1 |
Synchrotron site | CHESS |
Beamline | F1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-03-08 |
Detector | ADSC QUANTUM 4 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 37.316, 40.034, 58.744 |
Unit cell angles | 90.00, 98.61, 90.00 |
Refinement procedure
Resolution | 29.240 - 1.450 |
R-factor | 0.177 |
Rwork | 0.177 |
R-free | 0.21500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1lj0 |
RMSD bond length | 0.019 |
RMSD bond angle | 1.700 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | AMoRE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.240 | 1.500 |
High resolution limit [Å] | 1.450 | 1.450 |
Rmerge | 0.057 | 0.453 |
Number of reflections | 29891 | |
<I/σ(I)> | 18.45 | 2.13 |
Completeness [%] | 97.6 | |
Redundancy | 3.1 | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.8 | 278 | 30% PEG8K, 0.1M Hepes (pH 6.8) and 0.2M magnesium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 278K |