3HC1
Crystal structure of HDOD domain protein with unknown function (NP_953345.1) from GEOBACTER SULFURREDUCENS at 1.90 A resolution
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-03-19 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 0.91837,0.97932,0.97911 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 47.567, 66.631, 54.412 |
Unit cell angles | 90.00, 111.96, 90.00 |
Refinement procedure
Resolution | 28.375 - 1.900 |
R-factor | 0.182 |
Rwork | 0.180 |
R-free | 0.22600 |
Structure solution method | MAD |
RMSD bond length | 0.017 |
RMSD bond angle | 1.574 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.2.5) |
Phasing software | SHELX |
Refinement software | REFMAC (5.5.0053) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 28.375 | 28.380 | 1.950 |
High resolution limit [Å] | 1.900 | 8.500 | 1.900 |
Rmerge | 0.090 | 0.037 | 0.761 |
Total number of observations | 1063 | 6894 | |
Number of reflections | 24939 | ||
<I/σ(I)> | 11.6 | 34 | 1.9 |
Completeness [%] | 100.0 | 97.9 | 100 |
Redundancy | 3.8 | 3.6 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 277 | 0.2000M KThioCyanate, 20.0000% PEG-3350, No Buffer pH 7.0, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K |