5GV8
Structure of NADH-cytochrome b5 reductase refined with the multipolar atomic model at 0.78A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 40 |
Detector technology | CCD |
Collection date | 2011-02-02 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 0.65 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.480, 72.108, 84.908 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 31.900 - 0.780 |
Rwork | 0.122 |
R-free | 0.14000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ndh |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | SHELXL |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 31.900 | 0.790 |
High resolution limit [Å] | 0.780 | 0.780 |
Number of reflections | 332946 | |
<I/σ(I)> | 28.8 | 1.1 |
Completeness [%] | 99.1 | 89.5 |
Redundancy | 6.7 | 4.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 293 | PEG 4000, DTT, K-phos buffer |