Calcium in PDB 4gez: Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009

Protein crystallography data

The structure of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009, PDB code: 4gez was solved by H.Yang, P.J.Carney, R.O.Donis, J.Stevens, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 29.88 / 2.50
Space group P 1
Cell size a, b, c (Å), α, β, γ (°) 113.325, 113.331, 114.305, 81.47, 81.55, 67.72
R / Rfree (%) 21.8 / 26.2

Calcium Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 12;

Binding sites:

The binding sites of Calcium atom in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 (pdb code 4gez). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 12 binding sites of Calcium where determined in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009, PDB code: 4gez:
Jump to Calcium binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Calcium binding site 1 out of 12 in 4gez

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Calcium binding site 1 out of 12 in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009


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Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca501

b:34.0
occ:1.00
O A:ASN284 2.3 44.4 1.0
OD2 A:ASP314 2.4 35.2 1.0
O A:GLY334 2.4 35.3 1.0
O A:ASP288 2.4 42.8 1.0
O A:GLY332 2.5 41.7 1.0
CG A:ASP314 3.4 37.5 1.0
C A:ASN284 3.5 35.5 1.0
C A:GLY334 3.5 33.8 1.0
C A:ASP288 3.5 36.0 1.0
C A:GLY332 3.6 37.7 1.0
CA A:GLY335 4.0 23.3 1.0
O A:HOH617 4.0 19.1 1.0
CA A:GLY332 4.1 33.1 1.0
CA A:ALA289 4.2 30.1 1.0
N A:GLY335 4.2 28.6 1.0
OD1 A:ASP314 4.2 24.2 1.0
CB A:ASP314 4.2 37.1 1.0
N A:ALA289 4.3 35.8 1.0
N A:LEU285 4.4 23.1 1.0
CA A:LEU285 4.4 31.6 1.0
CA A:ASN284 4.4 35.1 1.0
C A:GLU333 4.5 31.6 1.0
N A:GLY334 4.5 30.1 1.0
N A:ASP288 4.5 33.0 1.0
CB A:ASN284 4.6 35.6 1.0
O A:LYS331 4.6 31.1 1.0
O A:PRO316 4.6 46.6 1.0
O A:GLU333 4.6 32.2 1.0
CA A:ASP288 4.6 34.1 1.0
N A:GLU333 4.6 39.0 1.0
CA A:GLY334 4.6 35.5 1.0
N A:ASN284 4.7 27.2 1.0
C A:LEU285 4.8 36.6 1.0
CA A:GLU333 5.0 35.7 1.0
N A:TRP286 5.0 32.4 1.0

Calcium binding site 2 out of 12 in 4gez

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Calcium binding site 2 out of 12 in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009


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Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca501

b:42.2
occ:1.00
O B:GLY334 2.3 30.6 1.0
O B:ASP288 2.3 34.4 1.0
O B:ASN284 2.4 34.5 1.0
OD2 B:ASP314 2.5 41.1 1.0
O B:GLY332 2.5 42.1 1.0
O B:HOH645 2.7 23.6 1.0
C B:ASP288 3.5 39.1 1.0
C B:GLY332 3.5 37.3 1.0
C B:GLY334 3.5 32.0 1.0
CG B:ASP314 3.5 38.0 1.0
C B:ASN284 3.6 29.0 1.0
CA B:ALA289 4.0 38.4 1.0
CA B:GLY332 4.0 37.4 1.0
CA B:GLY335 4.1 30.6 1.0
N B:ALA289 4.1 39.2 1.0
CB B:ASP314 4.2 35.3 1.0
N B:GLY335 4.2 32.3 1.0
C B:GLU333 4.3 47.3 1.0
N B:GLY334 4.3 44.1 1.0
O B:LYS331 4.3 49.8 1.0
OD1 B:ASP314 4.4 38.8 1.0
O B:GLU333 4.4 50.1 1.0
O B:PRO316 4.5 37.7 1.0
N B:ASP288 4.5 42.8 1.0
CA B:GLY334 4.5 34.3 1.0
N B:GLU333 4.5 41.0 1.0
N B:LEU285 4.5 19.9 1.0
CA B:ASP288 4.6 42.3 1.0
CA B:LEU285 4.6 22.8 1.0
CA B:ASN284 4.6 27.6 1.0
CB B:ASN284 4.7 28.3 1.0
N B:ASN284 4.8 29.0 1.0
CA B:GLU333 4.8 44.5 1.0
CB B:ALA289 4.9 37.0 1.0
C B:LEU285 4.9 35.0 1.0
C B:ALA289 4.9 31.3 1.0

Calcium binding site 3 out of 12 in 4gez

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Calcium binding site 3 out of 12 in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009


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Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 3 of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca501

b:37.6
occ:1.00
O C:ASN284 2.3 22.0 1.0
O C:HOH619 2.3 23.4 1.0
O C:ASP288 2.4 30.1 1.0
OD2 C:ASP314 2.4 47.1 1.0
O C:GLY334 2.5 31.0 1.0
O C:GLY332 2.5 47.2 1.0
CG C:ASP314 3.4 46.4 1.0
C C:ASP288 3.5 37.8 1.0
C C:ASN284 3.5 18.9 1.0
C C:GLY332 3.6 45.5 1.0
C C:GLY334 3.7 32.2 1.0
CA C:ALA289 4.1 35.6 1.0
CA C:GLY332 4.1 45.4 1.0
CA C:GLY335 4.2 17.7 1.0
N C:ALA289 4.2 38.0 1.0
OD1 C:ASP314 4.2 41.8 1.0
CB C:ASP314 4.3 39.6 1.0
N C:GLY335 4.4 22.8 1.0
N C:LEU285 4.4 19.9 1.0
CA C:LEU285 4.4 27.5 1.0
CA C:ASN284 4.4 27.3 1.0
N C:ASP288 4.5 37.8 1.0
CA C:ASP288 4.6 36.8 1.0
CB C:ASN284 4.6 30.4 1.0
N C:ASN284 4.6 32.7 1.0
N C:GLY334 4.6 24.1 1.0
C C:GLU333 4.6 41.1 1.0
O C:LYS331 4.7 39.8 1.0
N C:GLU333 4.7 44.3 1.0
O C:PRO316 4.7 25.0 1.0
O C:GLU333 4.7 49.0 1.0
C C:LEU285 4.8 32.7 1.0
CA C:GLY334 4.8 24.0 1.0
N C:TRP286 5.0 40.4 1.0

Calcium binding site 4 out of 12 in 4gez

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Calcium binding site 4 out of 12 in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009


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Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 4 of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Ca501

b:33.9
occ:1.00
O D:ASN284 2.3 31.5 1.0
O D:ASP288 2.4 49.4 1.0
O D:HOH618 2.4 22.8 1.0
OD2 D:ASP314 2.4 44.4 1.0
O D:GLY334 2.5 26.4 1.0
O D:GLY332 2.6 39.1 1.0
C D:ASP288 3.5 42.2 1.0
CG D:ASP314 3.5 41.5 1.0
C D:ASN284 3.5 28.2 1.0
C D:GLY332 3.6 37.8 1.0
C D:GLY334 3.6 31.2 1.0
CA D:GLY332 4.1 36.9 1.0
CA D:GLY335 4.1 31.4 1.0
CA D:ALA289 4.1 30.8 1.0
N D:ALA289 4.2 34.0 1.0
CB D:ASP314 4.2 39.6 1.0
N D:GLY335 4.3 32.7 1.0
OD1 D:ASP314 4.3 37.9 1.0
CA D:ASN284 4.4 30.0 1.0
N D:ASP288 4.4 43.6 1.0
N D:LEU285 4.5 29.1 1.0
CB D:ASN284 4.5 36.4 1.0
O D:LYS331 4.5 36.8 1.0
CA D:LEU285 4.5 30.4 1.0
CA D:ASP288 4.5 45.3 1.0
N D:GLY334 4.5 40.4 1.0
C D:GLU333 4.6 43.2 1.0
N D:ASN284 4.6 34.6 1.0
N D:GLU333 4.7 45.3 1.0
O D:GLU333 4.7 39.9 1.0
CA D:GLY334 4.7 31.6 1.0
O D:PRO316 4.7 37.3 1.0
C D:LEU285 4.9 31.4 1.0

Calcium binding site 5 out of 12 in 4gez

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Calcium binding site 5 out of 12 in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009


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Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 5 of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Ca501

b:41.1
occ:1.00
O E:ASN284 2.3 40.3 1.0
O E:GLY334 2.4 46.3 1.0
OD2 E:ASP314 2.4 33.5 1.0
O E:ASP288 2.4 43.8 1.0
O E:GLY332 2.5 37.7 1.0
CG E:ASP314 3.4 34.6 1.0
C E:ASP288 3.5 34.0 1.0
C E:GLY332 3.5 37.0 1.0
C E:GLY334 3.5 43.2 1.0
C E:ASN284 3.6 34.6 1.0
CA E:ALA289 4.0 19.3 1.0
CA E:GLY332 4.0 38.9 1.0
CA E:GLY335 4.1 36.4 1.0
CB E:ASP314 4.1 30.7 1.0
N E:ALA289 4.1 29.3 1.0
OD1 E:ASP314 4.2 34.2 1.0
N E:GLY335 4.2 38.9 1.0
O E:HOH604 4.3 20.4 1.0
C E:GLU333 4.3 48.6 1.0
N E:GLY334 4.4 45.7 1.0
CA E:LEU285 4.4 31.3 1.0
N E:LEU285 4.4 29.6 1.0
O E:LYS331 4.5 50.2 1.0
O E:GLU333 4.5 49.4 1.0
N E:GLU333 4.5 39.5 1.0
CA E:ASN284 4.5 34.2 1.0
N E:ASP288 4.5 30.7 1.0
CA E:ASP288 4.6 28.9 1.0
CA E:GLY334 4.6 43.4 1.0
O E:PRO316 4.6 52.6 1.0
CB E:ASN284 4.7 38.7 1.0
N E:ASN284 4.7 34.1 1.0
C E:LEU285 4.8 34.8 1.0
CA E:GLU333 4.8 46.9 1.0
CB E:ALA289 4.9 14.5 1.0
C E:ALA289 5.0 28.5 1.0

Calcium binding site 6 out of 12 in 4gez

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Calcium binding site 6 out of 12 in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009


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Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 6 of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Ca501

b:45.8
occ:1.00
O F:ASN284 2.4 23.6 1.0
O F:GLY334 2.4 33.8 1.0
OD2 F:ASP314 2.4 55.6 1.0
O F:GLY332 2.4 50.6 1.0
O F:HOH602 2.4 34.5 1.0
O F:ASP288 2.5 48.2 1.0
C F:GLY332 3.4 46.8 1.0
CG F:ASP314 3.5 45.8 1.0
C F:GLY334 3.5 31.8 1.0
C F:ASP288 3.6 49.9 1.0
C F:ASN284 3.6 30.5 1.0
CA F:GLY332 3.9 42.2 1.0
CA F:GLY335 4.1 22.5 1.0
O F:HOH635 4.1 38.4 1.0
CB F:ASP314 4.1 42.2 1.0
CA F:ALA289 4.2 45.1 1.0
N F:GLY335 4.3 21.3 1.0
N F:ALA289 4.3 44.4 1.0
OD1 F:ASP314 4.4 40.9 1.0
N F:GLY334 4.4 38.7 1.0
C F:GLU333 4.4 49.7 1.0
O F:LYS331 4.4 42.6 1.0
N F:ASP288 4.5 41.5 1.0
N F:LEU285 4.5 31.5 1.0
CA F:LEU285 4.5 32.2 1.0
CA F:ASN284 4.5 34.0 1.0
N F:GLU333 4.5 50.0 1.0
O F:PRO316 4.6 31.8 1.0
CA F:ASP288 4.6 49.8 1.0
CA F:GLY334 4.6 36.3 1.0
O F:GLU333 4.6 58.1 1.0
CB F:ASN284 4.6 28.6 1.0
N F:ASN284 4.7 40.8 1.0
C F:LEU285 4.8 40.2 1.0
CA F:GLU333 4.9 49.9 1.0
N F:TRP286 5.0 37.1 1.0

Calcium binding site 7 out of 12 in 4gez

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Calcium binding site 7 out of 12 in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009


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Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 7 of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 within 5.0Å range:
probe atom residue distance (Å) B Occ
G:Ca501

b:28.4
occ:1.00
O G:ASN284 2.3 26.1 1.0
O G:GLY334 2.4 25.4 1.0
O G:HOH612 2.4 25.5 1.0
O G:ASP288 2.4 39.0 1.0
OD2 G:ASP314 2.6 50.0 1.0
O G:GLY332 2.6 50.1 1.0
O G:HOH625 3.4 35.6 1.0
C G:GLY334 3.5 31.9 1.0
C G:ASP288 3.5 45.6 1.0
CG G:ASP314 3.6 51.8 1.0
C G:ASN284 3.6 35.6 1.0
C G:GLY332 3.6 46.9 1.0
CA G:ALA289 4.0 47.6 1.0
CA G:GLY335 4.0 28.4 1.0
N G:ALA289 4.2 53.0 1.0
CB G:ASP314 4.2 47.7 1.0
N G:GLY335 4.2 35.7 1.0
CA G:GLY332 4.2 44.6 1.0
N G:GLY334 4.4 25.4 1.0
C G:GLU333 4.5 50.9 1.0
N G:LEU285 4.5 32.7 1.0
OD1 G:ASP314 4.5 47.0 1.0
CA G:LEU285 4.5 42.6 1.0
CA G:ASN284 4.5 40.9 1.0
O G:LYS331 4.6 52.5 1.0
O G:GLU333 4.6 49.4 1.0
CA G:GLY334 4.6 24.5 1.0
O G:PRO316 4.6 31.6 1.0
N G:ASP288 4.6 51.3 1.0
CB G:ASN284 4.6 47.2 1.0
CA G:ASP288 4.7 49.8 1.0
N G:ASN284 4.7 32.3 1.0
N G:GLU333 4.7 51.7 1.0
CB G:ALA289 4.9 49.8 1.0
C G:LEU285 4.9 44.9 1.0
C G:ALA289 4.9 45.0 1.0
CA G:GLU333 5.0 54.9 1.0

Calcium binding site 8 out of 12 in 4gez

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Calcium binding site 8 out of 12 in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 8 of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 within 5.0Å range:
probe atom residue distance (Å) B Occ
H:Ca501

b:37.1
occ:1.00
O H:ASP288 2.3 45.3 1.0
O H:ASN284 2.4 31.8 1.0
O H:GLY334 2.4 32.1 1.0
O H:GLY332 2.5 49.1 1.0
OD2 H:ASP314 2.6 46.0 1.0
C H:ASP288 3.4 44.7 1.0
C H:GLY332 3.5 43.3 1.0
CG H:ASP314 3.6 47.3 1.0
C H:GLY334 3.6 30.2 1.0
C H:ASN284 3.6 35.0 1.0
CA H:ALA289 4.0 38.7 1.0
CA H:GLY332 4.0 39.1 1.0
N H:ALA289 4.1 39.6 1.0
CA H:GLY335 4.1 44.7 1.0
CB H:ASP314 4.2 46.3 1.0
N H:GLY335 4.3 37.9 1.0
O H:LYS331 4.4 46.9 1.0
OD1 H:ASP314 4.4 41.0 1.0
C H:GLU333 4.4 41.9 1.0
N H:GLY334 4.5 32.3 1.0
N H:ASP288 4.5 48.4 1.0
CA H:ASP288 4.5 46.6 1.0
N H:LEU285 4.5 33.8 1.0
CA H:ASN284 4.5 38.8 1.0
CA H:LEU285 4.6 40.5 1.0
O H:GLU333 4.6 45.0 1.0
N H:GLU333 4.6 45.0 1.0
O H:PRO316 4.6 58.2 1.0
CA H:GLY334 4.6 23.4 1.0
CB H:ASN284 4.7 44.4 1.0
N H:ASN284 4.7 40.3 1.0
CB H:ALA289 4.8 27.7 1.0
CA H:GLU333 4.9 45.4 1.0
C H:LEU285 4.9 38.6 1.0
C H:ALA289 4.9 42.4 1.0

Calcium binding site 9 out of 12 in 4gez

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Calcium binding site 9 out of 12 in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 9 of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Ca501

b:51.9
occ:1.00
O I:ASP288 2.3 47.0 1.0
O I:GLY334 2.3 51.5 1.0
O I:ASN284 2.4 54.9 1.0
OD2 I:ASP314 2.5 57.2 1.0
O I:GLY332 2.5 59.0 1.0
C I:ASP288 3.4 52.5 1.0
C I:GLY334 3.5 51.4 1.0
CG I:ASP314 3.5 60.8 1.0
C I:GLY332 3.5 57.0 1.0
C I:ASN284 3.7 44.3 1.0
CA I:GLY335 3.9 56.0 1.0
CA I:GLY332 4.0 58.2 1.0
CA I:ALA289 4.0 57.1 1.0
CB I:ASP314 4.1 61.4 1.0
N I:ALA289 4.1 57.1 1.0
N I:GLY335 4.1 54.2 1.0
OD1 I:ASP314 4.4 62.7 1.0
C I:GLU333 4.4 52.3 1.0
N I:GLY334 4.4 51.7 1.0
O I:LYS331 4.4 71.4 1.0
N I:ASP288 4.4 56.1 1.0
CA I:ASP288 4.5 60.7 1.0
O I:GLU333 4.5 47.2 1.0
CA I:LEU285 4.5 43.6 1.0
N I:LEU285 4.5 43.7 1.0
O I:PRO316 4.6 54.0 1.0
CA I:GLY334 4.6 45.4 1.0
N I:GLU333 4.6 58.5 1.0
CA I:ASN284 4.6 44.4 1.0
CB I:ASN284 4.8 44.5 1.0
N I:ASN284 4.8 60.0 1.0
C I:LEU285 4.9 43.2 1.0
CA I:GLU333 4.9 56.6 1.0
C I:ALA289 5.0 60.0 1.0
CB I:ALA289 5.0 53.1 1.0

Calcium binding site 10 out of 12 in 4gez

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Calcium binding site 10 out of 12 in the Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009


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Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 10 of Structure of A Neuraminidase-Like Protein From A/Bat/Guatemala/164/2009 within 5.0Å range:
probe atom residue distance (Å) B Occ
J:Ca501

b:65.5
occ:1.00
O J:ASN284 2.3 71.1 1.0
O J:GLY332 2.4 69.0 1.0
OD2 J:ASP314 2.4 70.2 1.0
O J:ASP288 2.5 60.5 1.0
O J:GLY334 2.6 66.7 1.0
C J:GLY332 3.5 72.3 1.0
CG J:ASP314 3.5 71.3 1.0
C J:ASN284 3.5 73.0 1.0
C J:ASP288 3.6 69.5 1.0
C J:GLY334 3.8 70.1 1.0
CA J:GLY332 4.0 72.4 1.0
CB J:ASP314 4.2 67.9 1.0
CA J:ALA289 4.3 78.0 1.0
CA J:GLY335 4.3 70.6 1.0
CA J:LEU285 4.3 74.6 1.0
N J:LEU285 4.4 71.0 1.0
OD1 J:ASP314 4.4 73.0 1.0
N J:ALA289 4.4 75.4 1.0
N J:GLY335 4.5 71.6 1.0
N J:GLY334 4.5 73.2 1.0
CA J:ASN284 4.5 74.1 1.0
C J:GLU333 4.6 74.9 1.0
O J:LYS331 4.6 79.3 1.0
N J:GLU333 4.6 74.8 1.0
N J:ASP288 4.6 65.7 1.0
CB J:ASN284 4.7 75.2 1.0
C J:LEU285 4.7 77.5 1.0
CA J:ASP288 4.7 68.4 1.0
CA J:GLY334 4.8 70.4 1.0
O J:PRO316 4.8 69.2 1.0
O J:GLU333 4.8 68.9 1.0
N J:ASN284 4.8 73.4 1.0
N J:TRP286 4.9 79.3 1.0
CA J:GLU333 4.9 78.4 1.0

Reference:

X.Zhu, H.Yang, Z.Guo, W.Yu, P.J.Carney, Y.Li, L.M.Chen, J.C.Paulson, R.O.Donis, S.Tong, J.Stevens, I.A.Wilson. Crystal Structures of Two Subtype N10 Neuraminidase-Like Proteins From Bat Influenza A Viruses Reveal A Diverged Putative Active Site. Proc.Natl.Acad.Sci.Usa V. 109 18903 2012.
ISSN: ISSN 0027-8424
PubMed: 23012478
DOI: 10.1073/PNAS.1212579109
Page generated: Sat Dec 12 04:47:49 2020

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