4O4Z
MURINE NEUROGLOBIN UNDER 30 BAR PRESSURE NITROUS Oxide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM16 |
Synchrotron site | ESRF |
Beamline | BM16 |
Temperature [K] | 291 |
Detector technology | CCD |
Collection date | 2009-10-22 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.979 |
Spacegroup name | H 3 2 |
Unit cell lengths | 89.275, 89.275, 114.765 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 20.000 - 1.700 |
R-factor | 0.17303 |
Rwork | 0.172 |
R-free | 0.18768 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3gkt |
RMSD bond length | 0.011 |
RMSD bond angle | 3.022 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | REFMAC |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.740 |
High resolution limit [Å] | 1.700 | 1.700 |
Number of reflections | 19567 | |
<I/σ(I)> | 26.1 | 6.4 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 7.3 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 1.6M ammonium sulphate, 0.1M MES, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |