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Magnesium in PDB 2x6v: Crystal Structure of Human TBX5 in the Dna-Bound and Dna- Free Form

Protein crystallography data

The structure of Crystal Structure of Human TBX5 in the Dna-Bound and Dna- Free Form, PDB code: 2x6v was solved by D.Ptchelkine, C.U.Stirnimann, C.Grimm, C.W.Mueller, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 19.707 / 2.20
Space group P 61 2 2
Cell size a, b, c (Å), α, β, γ (°) 118.240, 118.240, 243.000, 90.00, 90.00, 120.00
R / Rfree (%) 19.73 / 22.52

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Crystal Structure of Human TBX5 in the Dna-Bound and Dna- Free Form (pdb code 2x6v). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Crystal Structure of Human TBX5 in the Dna-Bound and Dna- Free Form, PDB code: 2x6v:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in 2x6v

Go back to Magnesium Binding Sites List in 2x6v
Magnesium binding site 1 out of 2 in the Crystal Structure of Human TBX5 in the Dna-Bound and Dna- Free Form


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Crystal Structure of Human TBX5 in the Dna-Bound and Dna- Free Form within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1239

b:61.4
occ:1.00
O A:SER86 2.7 40.8 1.0
OE1 A:GLU60 2.7 57.8 1.0
O A:HOH2005 3.1 37.5 1.0
CG A:LYS88 3.4 38.7 1.0
CD A:LYS88 3.6 39.2 1.0
C A:SER86 3.7 44.2 1.0
O A:HOH2007 3.7 42.2 1.0
CD2 A:HIS59 3.7 47.7 1.0
CD A:GLU60 3.8 61.4 1.0
CB A:SER86 3.8 37.7 1.0
CB A:LYS88 3.9 37.2 1.0
CE A:LYS88 4.0 40.3 1.0
CG A:GLU60 4.1 46.5 1.0
CB A:GLU60 4.2 40.5 1.0
CA A:SER86 4.2 41.1 1.0
N A:LYS88 4.2 35.2 1.0
N A:SER86 4.3 38.8 1.0
O A:HIS59 4.4 37.1 1.0
CG A:HIS59 4.5 47.6 1.0
CB A:HIS59 4.6 40.8 1.0
CA A:LYS88 4.7 34.0 1.0
N A:TYR87 4.7 35.9 1.0
C A:HIS59 4.7 41.0 1.0
C A:TYR87 4.8 35.9 1.0
NZ A:LYS88 4.8 47.6 1.0
NE2 A:HIS59 4.8 48.1 1.0
OE2 A:GLU60 4.8 58.7 1.0
OG A:SER86 4.9 43.1 1.0
CB A:PRO85 4.9 36.9 1.0
NE1 A:TRP64 4.9 37.4 1.0
CA A:TYR87 5.0 37.4 1.0

Magnesium binding site 2 out of 2 in 2x6v

Go back to Magnesium Binding Sites List in 2x6v
Magnesium binding site 2 out of 2 in the Crystal Structure of Human TBX5 in the Dna-Bound and Dna- Free Form


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Crystal Structure of Human TBX5 in the Dna-Bound and Dna- Free Form within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg1233

b:72.3
occ:1.00
OE1 B:GLU60 2.9 72.2 1.0
N B:SER86 3.4 42.8 1.0
CD B:GLU60 3.8 67.5 1.0
OG B:SER86 3.9 63.7 1.0
CB B:SER86 3.9 42.6 1.0
CA B:PRO85 4.0 41.1 1.0
OE2 B:GLU60 4.0 78.8 1.0
O B:HOH2009 4.1 61.0 1.0
CB B:PRO85 4.2 39.4 1.0
C B:PRO85 4.2 49.5 1.0
CA B:SER86 4.3 49.3 1.0
CD2 B:LEU63 4.6 58.7 1.0
O B:SER86 4.8 47.8 1.0
CE2 B:PHE84 4.8 56.5 1.0
CZ B:PHE84 4.8 62.0 1.0

Reference:

C.U.Stirnimann, D.Ptchelkine, C.Grimm, C.W.Muller. Structural Basis of TBX5-Dna Recognition: the T- Box Domain in Its Dna-Bound and -Unbound Form. J.Mol.Biol. V. 400 71 2010.
ISSN: ISSN 0022-2836
PubMed: 20450920
DOI: 10.1016/J.JMB.2010.04.052
Page generated: Wed Aug 14 07:00:40 2024

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