3BH1
Crystal structure of protein DIP2346 from Corynebacterium diphtheriae
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 77 |
Detector technology | CCD |
Collection date | 2005-02-26 |
Detector | MAR CCD 165 mm |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 95.453, 138.936, 98.266 |
Unit cell angles | 90.00, 116.49, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.510 |
R-factor | 0.21188 |
Rwork | 0.211 |
R-free | 0.27134 |
Structure solution method | SAD |
RMSD bond length | 0.008 |
RMSD bond angle | 1.146 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELX |
Refinement software | REFMAC (5.3.0034) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.610 |
High resolution limit [Å] | 2.510 | 2.510 |
Rmerge | 0.100 | 0.580 |
Number of reflections | 78192 | |
<I/σ(I)> | 4.4 | 1.1 |
Completeness [%] | 97.6 | 81.1 |
Redundancy | 2.6 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 294 | 100mM Bis-Tris pH 6.0, 30% PEG 3350, 200mM Ammonium acetate, 10% Glycerol, VAPOR DIFFUSION, SITTING DROP, temperature 294K |