6I3T
Crystal structure of murine neuroglobin bound to CO at 40 K.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 40 |
Detector technology | CCD |
Collection date | 2010-04-08 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.933 |
Spacegroup name | H 3 2 |
Unit cell lengths | 88.056, 88.056, 110.156 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 36.040 - 2.000 |
R-factor | 0.16989 |
Rwork | 0.167 |
R-free | 0.22175 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1q1f |
RMSD bond length | 0.014 |
RMSD bond angle | 1.467 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | REFMAC |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.630 | 2.100 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.053 | 0.236 |
Number of reflections | 11287 | 1614 |
<I/σ(I)> | 27.2 | 7.5 |
Completeness [%] | 99.9 | 100 |
Redundancy | 7.1 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M NA ACETATE, 2M NA FORMATE, PH 4.6 |