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Zinc in PDB 6foi: Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.

Enzymatic activity of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.

All present enzymatic activity of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.:
1.15.1.1;

Protein crystallography data

The structure of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated., PDB code: 6foi was solved by G.S.A.Wright, F.A.Sala, S.V.Antonyuk, R.C.Garratt, S.S.Hasnain, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 81.48 / 2.00
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 74.650, 162.959, 174.601, 90.00, 90.00, 90.00
R / Rfree (%) 22.1 / 25.9

Zinc Binding Sites:

Pages:

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

Binding sites:

The binding sites of Zinc atom in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. (pdb code 6foi). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 12 binding sites of Zinc where determined in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated., PDB code: 6foi:
Jump to Zinc binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Zinc binding site 1 out of 12 in 6foi

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Zinc binding site 1 out of 12 in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn201

b:25.4
occ:1.00
OD1 A:ASP83 1.9 25.8 1.0
ND1 A:HIS71 2.0 28.0 1.0
ND1 A:HIS63 2.1 25.9 1.0
ND1 A:HIS80 2.2 27.0 1.0
CG A:ASP83 2.7 26.5 1.0
OD2 A:ASP83 2.9 27.3 1.0
CE1 A:HIS71 2.9 27.8 1.0
CE1 A:HIS63 3.0 26.0 1.0
CE1 A:HIS80 3.0 27.9 1.0
CG A:HIS63 3.1 25.4 1.0
CG A:HIS71 3.1 29.0 1.0
CG A:HIS80 3.2 27.2 1.0
CB A:HIS63 3.5 25.4 1.0
CB A:HIS80 3.6 26.6 1.0
CB A:HIS71 3.6 29.8 1.0
O A:LYS136 3.6 29.3 1.0
CA A:HIS71 3.9 30.2 1.0
NE2 A:HIS71 4.1 28.6 1.0
NE2 A:HIS80 4.1 28.6 1.0
NE2 A:HIS63 4.1 25.7 1.0
CB A:ASP83 4.2 26.6 1.0
CD2 A:HIS71 4.2 29.4 1.0
CD2 A:HIS63 4.2 25.3 1.0
CD2 A:HIS80 4.2 28.2 1.0
CA A:ASP83 4.7 25.8 1.0
N A:GLY72 4.7 30.4 1.0
C A:LYS136 4.7 30.1 1.0
N A:HIS80 4.7 28.4 1.0
O A:HOH330 4.7 22.0 1.0
CA A:HIS80 4.8 27.5 1.0
C A:HIS71 4.9 30.9 1.0
N A:HIS71 4.9 31.3 1.0
N A:ASP83 4.9 25.3 1.0
CA A:HIS63 5.0 25.1 1.0

Zinc binding site 2 out of 12 in 6foi

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Zinc binding site 2 out of 12 in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Zn201

b:25.5
occ:1.00
OD1 F:ASP83 1.8 24.4 1.0
ND1 F:HIS63 2.1 24.8 1.0
ND1 F:HIS71 2.1 26.6 1.0
ND1 F:HIS80 2.2 27.4 1.0
CG F:ASP83 2.7 25.2 1.0
CE1 F:HIS71 3.0 26.0 1.0
OD2 F:ASP83 3.0 26.2 1.0
CE1 F:HIS63 3.0 24.7 1.0
CE1 F:HIS80 3.1 28.6 1.0
CG F:HIS63 3.1 24.5 1.0
CG F:HIS80 3.1 27.7 1.0
CG F:HIS71 3.2 27.9 1.0
CB F:HIS63 3.4 24.8 1.0
CB F:HIS80 3.5 26.8 1.0
CB F:HIS71 3.6 29.1 1.0
O F:LYS136 3.8 30.1 1.0
CA F:HIS71 3.9 29.6 1.0
NE2 F:HIS71 4.1 26.7 1.0
NE2 F:HIS80 4.2 29.7 1.0
NE2 F:HIS63 4.2 24.3 1.0
CB F:ASP83 4.2 24.9 1.0
CD2 F:HIS80 4.2 29.1 1.0
CD2 F:HIS63 4.2 24.2 1.0
CD2 F:HIS71 4.3 27.9 1.0
O F:HOH326 4.5 26.2 1.0
CA F:ASP83 4.7 24.0 1.0
N F:HIS80 4.7 28.3 1.0
CA F:HIS80 4.7 27.6 1.0
N F:GLY72 4.8 29.2 1.0
C F:LYS136 4.9 31.0 1.0
N F:HIS71 4.9 31.1 1.0
C F:HIS71 4.9 30.0 1.0
N F:ASP83 4.9 23.9 1.0
CA F:HIS63 4.9 24.7 1.0

Zinc binding site 3 out of 12 in 6foi

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Zinc binding site 3 out of 12 in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Zn201

b:28.5
occ:1.00
OD1 D:ASP83 2.0 30.0 1.0
ND1 D:HIS63 2.0 29.5 1.0
ND1 D:HIS71 2.0 31.6 1.0
ND1 D:HIS80 2.1 30.6 1.0
CG D:ASP83 2.8 30.5 1.0
CE1 D:HIS71 2.9 31.6 1.0
CE1 D:HIS63 2.9 29.8 1.0
CE1 D:HIS80 3.0 31.5 1.0
OD2 D:ASP83 3.0 31.4 1.0
CG D:HIS63 3.0 28.8 1.0
CG D:HIS80 3.1 30.6 1.0
CG D:HIS71 3.1 32.8 1.0
CB D:HIS63 3.4 28.5 1.0
CB D:HIS80 3.5 29.9 1.0
CB D:HIS71 3.6 33.4 1.0
O D:LYS136 3.8 31.7 1.0
CA D:HIS71 3.9 33.7 1.0
NE2 D:HIS80 4.1 32.2 1.0
NE2 D:HIS63 4.1 29.4 1.0
NE2 D:HIS71 4.1 32.7 1.0
CD2 D:HIS63 4.1 28.8 1.0
CD2 D:HIS80 4.1 31.7 1.0
CD2 D:HIS71 4.2 33.5 1.0
CB D:ASP83 4.3 30.5 1.0
CA D:ASP83 4.7 29.4 1.0
N D:HIS80 4.7 31.8 1.0
CA D:HIS80 4.8 30.7 1.0
N D:GLY72 4.8 34.2 1.0
C D:LYS136 4.8 32.7 1.0
C D:HIS71 4.9 34.6 1.0
N D:HIS71 4.9 34.5 1.0
N D:ASP83 4.9 28.6 1.0
CA D:HIS63 4.9 28.0 1.0
O D:HOH361 5.0 31.7 1.0

Zinc binding site 4 out of 12 in 6foi

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Zinc binding site 4 out of 12 in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 4 of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. within 5.0Å range:
probe atom residue distance (Å) B Occ
G:Zn201

b:23.9
occ:1.00
OD1 G:ASP83 1.8 24.3 1.0
ND1 G:HIS63 2.1 24.5 1.0
ND1 G:HIS71 2.1 25.3 1.0
ND1 G:HIS80 2.2 26.2 1.0
CG G:ASP83 2.7 25.0 1.0
OD2 G:ASP83 2.9 25.7 1.0
CE1 G:HIS71 2.9 24.8 1.0
CE1 G:HIS63 3.0 24.2 1.0
CE1 G:HIS80 3.1 27.0 1.0
CG G:HIS63 3.1 24.4 1.0
CG G:HIS80 3.1 26.8 1.0
CG G:HIS71 3.2 26.2 1.0
CB G:HIS63 3.4 24.9 1.0
CB G:HIS80 3.5 26.4 1.0
CB G:HIS71 3.7 27.2 1.0
O G:LYS136 3.8 28.0 1.0
CA G:HIS71 4.0 27.9 1.0
NE2 G:HIS71 4.1 25.1 1.0
CB G:ASP83 4.1 25.0 1.0
NE2 G:HIS80 4.2 28.0 1.0
NE2 G:HIS63 4.2 23.9 1.0
CD2 G:HIS80 4.2 27.9 1.0
CD2 G:HIS63 4.2 24.1 1.0
CD2 G:HIS71 4.3 26.0 1.0
CA G:ASP83 4.6 24.4 1.0
O G:HOH363 4.7 31.0 1.0
N G:HIS80 4.7 27.9 1.0
CA G:HIS80 4.7 27.4 1.0
N G:GLY72 4.8 27.9 1.0
C G:LYS136 4.8 28.5 1.0
N G:ASP83 4.9 24.6 1.0
CA G:HIS63 4.9 24.9 1.0
C G:HIS71 5.0 28.4 1.0
N G:HIS71 5.0 29.1 1.0

Zinc binding site 5 out of 12 in 6foi

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Zinc binding site 5 out of 12 in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 5 of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Zn201

b:39.8
occ:1.00
OD1 I:ASP83 1.9 44.3 1.0
ND1 I:HIS63 2.0 41.7 1.0
ND1 I:HIS71 2.2 44.3 1.0
ND1 I:HIS80 2.2 43.1 1.0
CG I:ASP83 2.8 45.3 1.0
OD2 I:ASP83 2.9 45.8 1.0
CE1 I:HIS63 3.0 41.9 1.0
CG I:HIS63 3.0 40.8 1.0
CE1 I:HIS71 3.0 44.8 1.0
CE1 I:HIS80 3.1 43.4 1.0
CG I:HIS80 3.2 43.9 1.0
CG I:HIS71 3.2 45.1 1.0
CB I:HIS63 3.3 40.6 1.0
CB I:HIS80 3.5 44.2 1.0
CB I:HIS71 3.6 45.2 1.0
O I:LYS136 3.8 41.9 1.0
CA I:HIS71 3.9 46.1 1.0
NE2 I:HIS63 4.1 41.2 1.0
CD2 I:HIS63 4.1 40.5 1.0
NE2 I:HIS80 4.2 44.2 1.0
NE2 I:HIS71 4.2 45.8 1.0
CB I:ASP83 4.2 46.4 1.0
CD2 I:HIS80 4.2 44.6 1.0
CD2 I:HIS71 4.3 46.0 1.0
CA I:ASP83 4.7 45.8 1.0
CA I:HIS80 4.7 45.8 1.0
N I:GLY72 4.8 47.8 1.0
N I:HIS80 4.8 47.0 1.0
C I:LYS136 4.8 42.4 1.0
CA I:HIS63 4.9 39.8 1.0
N I:ASP83 4.9 45.1 1.0
C I:HIS71 4.9 47.6 1.0
N I:HIS71 4.9 46.5 1.0

Zinc binding site 6 out of 12 in 6foi

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Zinc binding site 6 out of 12 in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 6 of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. within 5.0Å range:
probe atom residue distance (Å) B Occ
K:Zn201

b:33.1
occ:1.00
ND1 K:HIS71 1.9 34.0 1.0
ND1 K:HIS80 2.0 35.7 1.0
OD1 K:ASP83 2.1 31.8 1.0
ND1 K:HIS63 2.1 36.9 1.0
CE1 K:HIS80 2.7 37.2 1.0
CG K:ASP83 2.8 31.0 1.0
CE1 K:HIS71 2.8 33.3 1.0
OD2 K:ASP83 2.9 31.3 1.0
CE1 K:HIS63 3.0 37.3 1.0
CG K:HIS71 3.0 34.6 1.0
CG K:HIS63 3.1 37.8 1.0
CG K:HIS80 3.1 35.5 1.0
CB K:HIS63 3.4 37.9 1.0
CB K:HIS71 3.5 35.8 1.0
CB K:HIS80 3.7 34.2 1.0
O K:LYS136 3.9 40.9 1.0
NE2 K:HIS80 3.9 37.8 1.0
CA K:HIS71 3.9 35.1 1.0
NE2 K:HIS71 4.0 33.2 1.0
CD2 K:HIS80 4.1 36.8 1.0
CD2 K:HIS71 4.1 34.0 1.0
NE2 K:HIS63 4.2 38.5 1.0
CD2 K:HIS63 4.2 38.8 1.0
CB K:ASP83 4.2 29.8 1.0
CA K:ASP83 4.8 29.6 1.0
N K:GLY72 4.8 32.6 1.0
N K:HIS80 4.8 33.0 1.0
C K:LYS136 4.8 41.6 1.0
C K:HIS71 4.9 33.9 1.0
CA K:HIS80 4.9 33.6 1.0
N K:HIS71 4.9 36.5 1.0
O K:HOH347 4.9 40.2 1.0
N K:ASP83 5.0 30.2 1.0
CA K:HIS63 5.0 39.2 1.0

Zinc binding site 7 out of 12 in 6foi

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Zinc binding site 7 out of 12 in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 7 of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. within 5.0Å range:
probe atom residue distance (Å) B Occ
M:Zn201

b:25.7
occ:1.00
OD1 M:ASP83 1.9 26.6 1.0
ND1 M:HIS80 2.1 28.4 1.0
ND1 M:HIS71 2.2 27.7 1.0
ND1 M:HIS63 2.2 28.5 1.0
CG M:ASP83 2.7 26.6 1.0
OD2 M:ASP83 2.8 26.5 1.0
CE1 M:HIS80 3.0 28.8 1.0
CE1 M:HIS71 3.0 27.5 1.0
CG M:HIS80 3.1 28.5 1.0
CE1 M:HIS63 3.1 28.8 1.0
CG M:HIS63 3.2 29.3 1.0
CG M:HIS71 3.3 27.8 1.0
CB M:HIS63 3.4 29.5 1.0
CB M:HIS80 3.5 28.3 1.0
CB M:HIS71 3.7 28.3 1.0
O M:LYS136 3.7 30.1 1.0
CA M:HIS71 4.0 28.3 1.0
NE2 M:HIS80 4.1 29.2 1.0
CD2 M:HIS80 4.1 29.1 1.0
CB M:ASP83 4.1 26.6 1.0
NE2 M:HIS71 4.2 27.6 1.0
NE2 M:HIS63 4.3 29.6 1.0
CD2 M:HIS63 4.3 29.9 1.0
CD2 M:HIS71 4.3 27.7 1.0
N M:HIS80 4.7 28.1 1.0
CA M:ASP83 4.7 27.0 1.0
CA M:HIS80 4.7 28.4 1.0
C M:LYS136 4.8 30.7 1.0
N M:GLY72 4.8 27.7 1.0
O M:HOH345 4.8 27.7 1.0
N M:ASP83 4.9 27.4 1.0
C M:HIS71 5.0 28.0 1.0
CA M:HIS63 5.0 30.6 1.0
N M:HIS71 5.0 29.1 1.0

Zinc binding site 8 out of 12 in 6foi

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Zinc binding site 8 out of 12 in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 8 of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. within 5.0Å range:
probe atom residue distance (Å) B Occ
O:Zn201

b:64.9
occ:1.00
OD1 O:ASP83 2.1 68.3 1.0
ND1 O:HIS63 2.2 68.7 1.0
ND1 O:HIS80 2.2 70.5 1.0
ND1 O:HIS71 2.3 74.2 1.0
CG O:ASP83 2.8 69.2 1.0
OD2 O:ASP83 2.9 70.4 1.0
CE1 O:HIS80 3.1 72.8 1.0
CG O:HIS63 3.1 66.7 1.0
CE1 O:HIS63 3.2 69.8 1.0
CE1 O:HIS71 3.2 74.4 1.0
CG O:HIS80 3.2 69.9 1.0
CG O:HIS71 3.3 77.1 1.0
CB O:HIS63 3.3 65.3 1.0
CB O:HIS80 3.6 67.7 1.0
CB O:HIS71 3.6 77.9 1.0
O O:LYS136 3.9 74.9 0.8
CA O:HIS71 3.9 77.7 1.0
NE2 O:HIS80 4.1 73.7 1.0
CD2 O:HIS80 4.2 71.9 1.0
CD2 O:HIS63 4.3 66.5 1.0
CB O:ASP83 4.3 68.8 1.0
NE2 O:HIS63 4.3 68.5 1.0
NE2 O:HIS71 4.3 77.3 1.0
CD2 O:HIS71 4.4 79.0 1.0
N O:GLY72 4.7 78.0 1.0
N O:HIS80 4.7 70.9 1.0
CA O:HIS80 4.8 68.4 1.0
CA O:HIS63 4.8 63.5 1.0
C O:HIS71 4.9 79.5 1.0
CA O:ASP83 4.9 66.4 1.0
C O:LYS136 4.9 77.5 0.8
N O:HIS71 4.9 79.1 1.0
N O:ASP83 5.0 64.3 1.0

Zinc binding site 9 out of 12 in 6foi

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Zinc binding site 9 out of 12 in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 9 of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. within 5.0Å range:
probe atom residue distance (Å) B Occ
Q:Zn201

b:26.9
occ:1.00
OD1 Q:ASP83 1.8 26.7 1.0
ND1 Q:HIS80 2.0 29.7 1.0
ND1 Q:HIS71 2.1 27.4 1.0
ND1 Q:HIS63 2.2 29.7 1.0
CG Q:ASP83 2.7 26.4 1.0
OD2 Q:ASP83 2.9 26.2 1.0
CE1 Q:HIS80 2.9 30.3 1.0
CE1 Q:HIS71 2.9 26.8 1.0
CG Q:HIS80 3.0 30.0 1.0
CG Q:HIS63 3.1 31.2 1.0
CE1 Q:HIS63 3.1 29.4 1.0
CG Q:HIS71 3.2 27.4 1.0
CB Q:HIS63 3.4 32.4 1.0
CB Q:HIS80 3.5 29.8 1.0
CB Q:HIS71 3.7 28.4 1.0
O Q:LYS136 3.8 30.1 1.0
CA Q:HIS71 3.9 28.6 1.0
NE2 Q:HIS80 4.0 31.1 1.0
CD2 Q:HIS80 4.1 30.9 1.0
CB Q:ASP83 4.1 26.2 1.0
NE2 Q:HIS71 4.1 26.4 1.0
NE2 Q:HIS63 4.2 30.6 1.0
CD2 Q:HIS71 4.3 26.7 1.0
CD2 Q:HIS63 4.3 31.8 1.0
CA Q:ASP83 4.6 26.8 1.0
N Q:HIS80 4.7 28.8 1.0
CA Q:HIS80 4.7 29.8 1.0
N Q:GLY72 4.7 26.9 1.0
C Q:LYS136 4.8 30.2 1.0
N Q:ASP83 4.9 27.9 1.0
O Q:HOH341 4.9 29.4 1.0
C Q:HIS71 4.9 27.6 1.0
N Q:HIS71 4.9 30.1 1.0
CA Q:HIS63 4.9 34.5 1.0
CD2 Q:HIS46 5.0 27.6 1.0

Zinc binding site 10 out of 12 in 6foi

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Zinc binding site 10 out of 12 in the Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 10 of Human CYS57/156ALA Superoxide Dismutase-1 (SOD1), As Isolated. within 5.0Å range:
probe atom residue distance (Å) B Occ
S:Zn201

b:37.8
occ:0.80
OD1 S:ASP83 2.0 47.7 1.0
ND1 S:HIS71 2.1 52.6 1.0
ND1 S:HIS80 2.1 50.7 1.0
ND1 S:HIS63 2.2 50.7 1.0
CG S:ASP83 2.8 47.9 1.0
OD2 S:ASP83 2.9 48.9 1.0
CE1 S:HIS71 3.0 52.4 1.0
CE1 S:HIS80 3.0 52.6 1.0
CG S:HIS80 3.0 50.0 1.0
CG S:HIS63 3.1 50.0 1.0
CG S:HIS71 3.2 54.5 1.0
CE1 S:HIS63 3.2 51.7 1.0
CB S:HIS63 3.4 49.1 1.0
CB S:HIS80 3.4 48.2 1.0
O S:LYS136 3.7 56.6 1.0
CB S:HIS71 3.7 55.6 1.0
CA S:HIS71 4.0 54.9 1.0
NE2 S:HIS80 4.1 53.2 1.0
CD2 S:HIS80 4.1 51.6 1.0
NE2 S:HIS71 4.1 54.0 1.0
CB S:ASP83 4.2 47.1 1.0
CD2 S:HIS71 4.3 55.4 1.0
CD2 S:HIS63 4.3 50.5 1.0
NE2 S:HIS63 4.3 51.6 1.0
O S:HOH301 4.4 34.3 1.0
CA S:HIS80 4.6 48.2 1.0
N S:HIS80 4.6 49.2 1.0
C S:LYS136 4.8 58.8 1.0
N S:GLY72 4.8 53.7 1.0
CA S:ASP83 4.8 45.9 1.0
CA S:HIS63 4.9 48.7 1.0
N S:ASP83 4.9 45.0 1.0
N S:HIS71 5.0 56.4 1.0
C S:HIS71 5.0 55.3 1.0

Reference:

F.A.Sala, G.S.A.Wright, S.V.Antonyuk, R.C.Garratt, S.S.Hasnain. Molecular Recognition and Maturation of SOD1 By Its Evolutionarily Destabilised Cognate Chaperone Hccs. Plos Biol. V. 17 00141 2019.
ISSN: ESSN 1545-7885
PubMed: 30735496
DOI: 10.1371/JOURNAL.PBIO.3000141
Page generated: Mon Oct 28 21:13:47 2024

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