3CVG
Crystal structure of a periplasmic putative metal binding protein
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-02-14 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.97958 |
Spacegroup name | P 42 21 2 |
Unit cell lengths | 150.782, 150.782, 116.687 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.140 - 1.970 |
R-factor | 0.259 |
Rwork | 0.259 |
R-free | 0.28900 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.300 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXD |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.060 | 0.600 |
Number of reflections | 103728 | |
<I/σ(I)> | 7.3 | 1 |
Completeness [%] | 98.0 | 82.1 |
Redundancy | 22.6 | 10.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 298 | Bis-tris, PEG 3350, MgCl2, CaCl2, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |