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Magnesium in PDB 3pov: Crystal Structure of A Sox-Dna Complex

Protein crystallography data

The structure of Crystal Structure of A Sox-Dna Complex, PDB code: 3pov was solved by C.Bagneris, T.E.Barrett, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 63.09 / 2.50
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 54.520, 67.660, 174.560, 90.00, 90.00, 90.00
R / Rfree (%) 20.6 / 26.4

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Crystal Structure of A Sox-Dna Complex (pdb code 3pov). 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 A Sox-Dna Complex, PDB code: 3pov:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in 3pov

Go back to Magnesium Binding Sites List in 3pov
Magnesium binding site 1 out of 2 in the Crystal Structure of A Sox-Dna Complex


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 A Sox-Dna Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg487

b:80.0
occ:1.00
OD2 A:ASP221 2.8 38.5 1.0
OE2 A:GLU244 2.9 74.4 1.0
O A:ILE245 2.9 41.0 1.0
OE2 A:GLU184 3.3 73.6 1.0
NZ A:LYS246 3.3 32.8 1.0
CG A:ASP221 3.5 39.4 1.0
OD1 A:ASP221 3.5 50.2 1.0
CD A:GLU244 3.7 68.9 1.0
C A:ILE245 4.0 42.1 1.0
OE1 A:GLU184 4.1 79.5 1.0
CD A:GLU184 4.1 75.0 1.0
CE A:LYS246 4.2 36.3 1.0
CD A:LYS246 4.2 41.5 1.0
N A:ILE245 4.3 30.3 1.0
OE1 A:GLU244 4.3 72.6 1.0
CA A:ILE245 4.6 39.8 1.0
CG A:GLU244 4.6 51.2 1.0
O A:HOH596 4.8 47.9 1.0
CB A:ILE245 4.8 41.1 1.0
CB A:ASP221 4.9 36.2 1.0

Magnesium binding site 2 out of 2 in 3pov

Go back to Magnesium Binding Sites List in 3pov
Magnesium binding site 2 out of 2 in the Crystal Structure of A Sox-Dna Complex


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 A Sox-Dna Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg488

b:64.1
occ:1.00
O A:HOH523 3.0 58.8 1.0
OP1 C:DG3 3.0 59.0 1.0
N A:CYS247 3.1 35.2 1.0
OE1 A:GLU184 3.3 79.5 1.0
C5' C:DG3 3.6 34.9 1.0
CA A:LYS246 3.6 32.5 1.0
C A:LYS246 3.7 33.5 1.0
O3' C:DG2 3.8 56.5 1.0
P C:DG3 3.9 57.8 1.0
CB A:CYS247 3.9 30.5 1.0
CD A:LYS246 3.9 41.5 1.0
CA A:CYS247 4.0 31.7 1.0
CB A:LYS246 4.0 35.7 1.0
O A:CYS247 4.0 35.7 1.0
OH A:TYR373 4.0 37.8 1.0
O A:HOH596 4.1 47.9 1.0
O5' C:DG3 4.2 52.1 1.0
C A:CYS247 4.5 35.0 1.0
SG A:CYS247 4.5 45.7 1.0
CD A:GLU184 4.6 75.0 1.0
CG A:LYS246 4.6 42.8 1.0
O A:ILE245 4.6 41.0 1.0
O A:LYS246 4.8 33.2 1.0
C3' C:DG2 4.8 64.1 1.0
N A:LYS246 4.8 32.2 1.0
C4' C:DG3 4.9 37.2 1.0
C4' C:DG2 4.9 66.4 1.0

Reference:

C.Bagneris, L.C.Briggs, R.Savva, B.Ebrahimi, T.E.Barrett. Crystal Structure of A Kshv-Sox-Dna Complex: Insights Into the Molecular Mechanisms Underlying Dnase Activity and Host Shutoff Nucleic Acids Res. V. 39 5744 2011.
ISSN: ISSN 0305-1048
PubMed: 21421561
DOI: 10.1093/NAR/GKR111
Page generated: Thu Aug 15 09:41:19 2024

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