3HDX
Crystal structure of SusD superfamily protein (NP_809182.1) from BACTEROIDES THETAIOTAOMICRON VPI-5482 at 1.50 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) | 0.91162,0.97932,0.97918 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 56.221, 56.221, 301.899 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.235 - 1.500 |
R-factor | 0.136 |
Rwork | 0.134 |
R-free | 0.16000 |
Structure solution method | MAD |
RMSD bond length | 0.016 |
RMSD bond angle | 1.537 |
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] | 29.235 | 29.240 | 1.540 |
High resolution limit [Å] | 1.500 | 6.710 | 1.500 |
Rmerge | 0.106 | 0.046 | 0.814 |
Total number of observations | 6476 | 34200 | |
Number of reflections | 79386 | ||
<I/σ(I)> | 5.33 | 11.9 | 0.9 |
Completeness [%] | 100.0 | 98.8 | 99.9 |
Redundancy | 7.1 | 6 | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.7 | 277 | 0.2000M MgAcetate, 20.0000% PEG-3350, No Buffer pH 7.7, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K |