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Barium in PDB 7dik: Structure of PFGRX1 with Barium

Enzymatic activity of Structure of PFGRX1 with Barium

All present enzymatic activity of Structure of PFGRX1 with Barium:
1.8.4.2;

Protein crystallography data

The structure of Structure of PFGRX1 with Barium, PDB code: 7dik was solved by Y.Manickam, A.Sharma, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 24.11 / 1.55
Space group P 32 2 1
Cell size a, b, c (Å), α, β, γ (°) 48.224, 48.224, 82.989, 90, 90, 120
R / Rfree (%) 13.2 / 17.3

Barium Binding Sites:

The binding sites of Barium atom in the Structure of PFGRX1 with Barium (pdb code 7dik). This binding sites where shown within 5.0 Angstroms radius around Barium atom.
In total 4 binding sites of Barium where determined in the Structure of PFGRX1 with Barium, PDB code: 7dik:
Jump to Barium binding site number: 1; 2; 3; 4;

Barium binding site 1 out of 4 in 7dik

Go back to Barium Binding Sites List in 7dik
Barium binding site 1 out of 4 in the Structure of PFGRX1 with Barium


Mono view


Stereo pair view

A full contact list of Barium with other atoms in the Ba binding site number 1 of Structure of PFGRX1 with Barium within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ba203

b:54.5
occ:0.35
BA A:BA206 2.7 82.0 0.3
O A:PRO57 2.9 19.7 1.0
HB2 A:PRO57 3.2 21.8 1.0
O A:HOH360 3.5 31.6 1.0
O A:HOH412 3.7 34.6 1.0
C A:PRO57 3.8 16.5 1.0
HA A:PRO57 3.8 19.6 1.0
CB A:PRO57 3.8 18.2 1.0
HB3 A:PRO57 3.9 21.8 1.0
CA A:PRO57 4.0 16.4 1.0
O A:HOH315 4.1 29.1 1.0
OD1 A:ASP58 4.8 23.4 1.0
HA A:ASP58 4.8 17.4 1.0
O A:HOH403 4.9 28.6 1.0
N A:ASP58 4.9 15.0 1.0

Barium binding site 2 out of 4 in 7dik

Go back to Barium Binding Sites List in 7dik
Barium binding site 2 out of 4 in the Structure of PFGRX1 with Barium


Mono view


Stereo pair view

A full contact list of Barium with other atoms in the Ba binding site number 2 of Structure of PFGRX1 with Barium within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ba204

b:44.1
occ:0.29
OE1 A:GLU28 2.6 33.4 1.0
O A:HOH419 2.7 55.8 0.5
HB2 A:GLU28 3.7 27.7 1.0
HB3 A:GLU28 3.7 27.7 1.0
CD A:GLU28 3.8 32.2 1.0
CB A:GLU28 4.1 23.1 1.0
CG A:GLU28 4.5 25.7 1.0
OE2 A:GLU28 4.7 37.6 1.0

Barium binding site 3 out of 4 in 7dik

Go back to Barium Binding Sites List in 7dik
Barium binding site 3 out of 4 in the Structure of PFGRX1 with Barium


Mono view


Stereo pair view

A full contact list of Barium with other atoms in the Ba binding site number 3 of Structure of PFGRX1 with Barium within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ba205

b:53.1
occ:0.25
O A:ASN45 2.7 18.4 1.0
O A:MET48 2.8 16.1 1.0
O A:HOH373 2.8 30.4 0.8
O A:HOH359 2.9 23.6 1.0
H A:MET48 3.4 16.8 1.0
HA A:SER46 3.8 20.3 1.0
C A:MET48 3.9 14.1 1.0
C A:ASN45 3.9 17.8 1.0
HB2 A:MET48 4.1 20.6 1.0
N A:MET48 4.1 14.0 1.0
C A:SER46 4.3 15.9 1.0
O A:SER46 4.4 17.0 1.0
CA A:MET48 4.4 13.6 1.0
CA A:SER46 4.4 16.9 1.0
HA A:HIS49 4.6 17.5 1.0
N A:SER46 4.7 18.0 1.0
CB A:MET48 4.7 17.2 1.0
HB3 A:MET48 4.7 20.6 1.0
HA A:ASN45 4.8 21.0 1.0
N A:HIS47 4.8 15.2 1.0
O A:HOH379 4.9 24.6 1.0
HB3 A:ASN45 4.9 27.3 1.0
CA A:ASN45 5.0 17.5 1.0

Barium binding site 4 out of 4 in 7dik

Go back to Barium Binding Sites List in 7dik
Barium binding site 4 out of 4 in the Structure of PFGRX1 with Barium


Mono view


Stereo pair view

A full contact list of Barium with other atoms in the Ba binding site number 4 of Structure of PFGRX1 with Barium within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ba206

b:82.0
occ:0.35
BA A:BA203 2.7 54.5 0.3
O A:HOH315 2.8 29.1 1.0
O A:PRO57 3.5 19.7 1.0
O A:HOH403 3.7 28.6 1.0
O A:HOH302 4.1 28.7 1.0
O A:HOH412 4.1 34.6 1.0
HA A:ASP58 4.4 17.4 1.0
O A:HOH360 4.7 31.6 1.0
C A:PRO57 4.7 16.5 1.0
OD1 A:ASP58 4.9 23.4 1.0

Reference:

Y.Manickam, A.Sharma. Interaction of Metals with PFGRX1 To Be Published.
Page generated: Thu Nov 25 07:44:14 2021

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