Barium in PDB 4ltj: Dehydration/Rehydration of A Nucleic Acid System Containing A Polypyridyl Ruthenium Complex at 97% Relative Humidity (5/7)

The structure of Dehydration/Rehydration of A Nucleic Acid System Containing A Polypyridyl Ruthenium Complex at 97% Relative Humidity (5/7), PDB code: 4ltj was solved by J.P.Hall, J.Sanchez-Weatherby, C.J.Cardin, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	30.48 / 1.80
Space group	P 43 21 2
Cell size a, b, c (Å), α, β, γ (°)	43.100, 43.100, 39.420, 90.00, 90.00, 90.00
R / Rfree (%)	14.7 / 18

The structure of Dehydration/Rehydration of A Nucleic Acid System Containing A Polypyridyl Ruthenium Complex at 97% Relative Humidity (5/7) also contains other interesting chemical elements:

Ruthenium

(Ru)

1 atom

The binding sites of Barium atom in the Dehydration/Rehydration of A Nucleic Acid System Containing A Polypyridyl Ruthenium Complex at 97% Relative Humidity (5/7) (pdb code 4ltj). This binding sites where shown within 5.0 Angstroms radius around Barium atom.
In total only one binding site of Barium was determined in the Dehydration/Rehydration of A Nucleic Acid System Containing A Polypyridyl Ruthenium Complex at 97% Relative Humidity (5/7), PDB code: 4ltj:

Barium binding site 1 out of 1 in the Dehydration/Rehydration of A Nucleic Acid System Containing A Polypyridyl Ruthenium Complex at 97% Relative Humidity (5/7)


Mono view


Stereo pair view

A full contact list of Barium with other atoms in the Ba binding site number 1 of Dehydration/Rehydration of A Nucleic Acid System Containing A Polypyridyl Ruthenium Complex at 97% Relative Humidity (5/7) within 5.0Å range: probe atom residue distance (Å) B Occ A:Ba102 b:27.6 occ:1.00 O A:HOH203 2.7 28.5 1.0 O A:HOH206 2.8 28.5 1.0 O A:HOH212 2.8 50.3 1.0 O6 A:DG4 2.9 22.8 1.0 N7 A:DG3 3.0 24.0 1.0 O A:HOH204 3.0 27.6 1.0 O A:HOH213 3.0 35.7 1.0 N7 A:DG4 3.1 24.9 1.0 C6 A:DG4 3.6 22.1 1.0 C8 A:DG3 3.7 24.1 1.0 C5 A:DG4 3.7 23.7 1.0 C5 A:DG3 4.1 23.8 1.0 C8 A:DG4 4.3 24.3 1.0 O6 A:DG3 4.5 24.1 1.0 OP2 A:DG3 4.7 29.6 1.0 C6 A:DG3 4.7 23.5 1.0 N1 A:DG4 4.9 23.7 1.0 N9 A:DG3 5.0 23.8 1.0

J.P.Hall, J.Sanchez-Weatherby, K.O'sullivan, J.M.Kelly, C.J.Cardin. Controlled Dehydration of A Ruthenium-Bound Dna Oligonucleotide Complex Induces Reversible Kinking To Be Published.