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Sodium in PDB 5kw9: Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody

Protein crystallography data

The structure of Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody, PDB code: 5kw9 was solved by S.Shanker, B.V.V.Prasad, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 81.00 / 2.30
Space group P 65 2 2
Cell size a, b, c (Å), α, β, γ (°) 162.000, 162.000, 146.810, 90.00, 90.00, 120.00
R / Rfree (%) 18.6 / 21.2

Other elements in 5kw9:

The structure of Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody also contains other interesting chemical elements:

Magnesium (Mg) 5 atoms

Sodium Binding Sites:

The binding sites of Sodium atom in the Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody (pdb code 5kw9). This binding sites where shown within 5.0 Angstroms radius around Sodium atom.
In total 3 binding sites of Sodium where determined in the Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody, PDB code: 5kw9:
Jump to Sodium binding site number: 1; 2; 3;

Sodium binding site 1 out of 3 in 5kw9

Go back to Sodium Binding Sites List in 5kw9
Sodium binding site 1 out of 3 in the Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 1 of Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na601

b:66.1
occ:1.00
O A:HOH870 2.4 43.7 1.0
O A:HOH778 3.3 39.9 1.0
NE2 A:HIS337 3.6 37.3 1.0
CE1 A:HIS337 4.0 39.3 1.0
CA A:GLY367 4.2 30.1 1.0
CD2 A:HIS337 4.6 35.8 1.0
NE2 A:GLN334 4.8 28.7 1.0
O A:HOH877 4.9 53.4 1.0
O A:SER366 4.9 30.1 1.0
N A:ASN368 4.9 30.0 1.0
O A:HOH832 5.0 43.2 1.0

Sodium binding site 2 out of 3 in 5kw9

Go back to Sodium Binding Sites List in 5kw9
Sodium binding site 2 out of 3 in the Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 2 of Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na602

b:44.8
occ:1.00
O A:HOH731 3.7 33.2 1.0
O A:HOH763 3.9 65.9 1.0
NE2 A:GLN342 4.1 27.9 1.0
CZ2 A:TRP375 4.1 28.6 1.0
CH2 A:TRP375 4.3 28.8 1.0
OE1 A:GLN342 4.8 28.0 1.0
CD A:GLN342 4.9 28.7 1.0

Sodium binding site 3 out of 3 in 5kw9

Go back to Sodium Binding Sites List in 5kw9
Sodium binding site 3 out of 3 in the Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 3 of Structural Basis For Norovirus Neutralization By A Hbga Blocking Human Iga Antibody within 5.0Å range:
probe atom residue distance (Å) B Occ
L:Na301

b:48.7
occ:1.00
OH L:TYR38 2.5 34.8 1.0
NE2 A:HIS381 2.7 37.0 1.0
CD2 L:TYR31 3.1 30.9 1.0
CE2 L:TYR31 3.2 33.8 1.0
CZ L:TYR38 3.3 33.5 1.0
CE1 A:HIS381 3.5 36.8 1.0
CD2 A:HIS381 3.6 34.4 1.0
CE2 L:TYR38 3.9 34.2 1.0
OD2 L:ASP34 3.9 41.7 1.0
CG L:TYR31 4.2 29.6 1.0
CE1 L:TYR38 4.2 32.3 1.0
CZ L:TYR31 4.2 33.7 1.0
O H:HOH419 4.3 37.4 1.0
CG A:PRO382 4.5 30.4 1.0
O H:HOH442 4.5 50.9 1.0
CB A:PRO382 4.6 30.9 1.0
ND1 A:HIS381 4.6 35.0 1.0
CG A:HIS381 4.7 33.2 1.0
CG L:ASP34 4.7 40.7 1.0
OD2 H:ASP108 4.8 35.3 1.0
CB L:TYR31 4.9 29.4 1.0
OH L:TYR31 4.9 31.4 1.0
O L:HOH449 4.9 54.6 1.0
O L:HOH430 5.0 42.0 1.0

Reference:

S.Shanker, R.Czako, G.Sapparapu, G.Alvarado, M.Viskovska, B.Sankaran, R.L.Atmar, J.E.Crowe, M.K.Estes, B.V.Prasad. Structural Basis For Norovirus Neutralization By An Hbga Blocking Human Iga Antibody. Proc.Natl.Acad.Sci.Usa V. 113 E5830 2016.
ISSN: ESSN 1091-6490
PubMed: 27647885
DOI: 10.1073/PNAS.1609990113
Page generated: Mon Oct 7 22:11:20 2024

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