3DWJ
Heme-proximal W188H mutant of inducible nitric oxide synthase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 4.2.2 |
Synchrotron site | ALS |
Beamline | 4.2.2 |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2007-10-31 |
Detector | NOIR-1 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 214.597, 214.597, 111.933 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 43.770 - 2.750 |
R-factor | 0.229 |
Rwork | 0.226 |
R-free | 0.29400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1nod |
RMSD bond length | 0.009 |
RMSD bond angle | 1.486 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | PHENIX |
Refinement software | PHENIX (phenix) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.800 | 2.850 |
High resolution limit [Å] | 2.750 | 2.750 |
Rmerge | 0.108 | 0.423 |
Number of reflections | 37844 | |
<I/σ(I)> | 6.7 | 2.1 |
Completeness [%] | 95.0 | 94.4 |
Redundancy | 4.53 | 4.49 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.3 | 277 | 0.7-1.2M (NH4)2SO4, 0.1M MES, pH 4.9-5.7, pH 5.3, VAPOR DIFFUSION, HANGING DROP, temperature 277K |