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Zinc in PDB 8k33: SOD1 and NANOBODY1 Complex

Enzymatic activity of SOD1 and NANOBODY1 Complex

All present enzymatic activity of SOD1 and NANOBODY1 Complex:
1.15.1.1;

Protein crystallography data

The structure of SOD1 and NANOBODY1 Complex, PDB code: 8k33 was solved by S.Cheng, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 112.16 / 2.13
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 112.208, 119.67, 130.707, 90, 91.64, 90
R / Rfree (%) 21.7 / 26.5

Zinc Binding Sites:

Pages:

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

Binding sites:

The binding sites of Zinc atom in the SOD1 and NANOBODY1 Complex (pdb code 8k33). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 12 binding sites of Zinc where determined in the SOD1 and NANOBODY1 Complex, PDB code: 8k33:
Jump to Zinc binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Zinc binding site 1 out of 12 in 8k33

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Zinc binding site 1 out of 12 in the SOD1 and NANOBODY1 Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of SOD1 and NANOBODY1 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn201

b:31.0
occ:1.00
OD1 A:ASP83 2.0 28.2 1.0
ND1 A:HIS71 2.3 28.8 1.0
ND1 A:HIS63 2.3 32.2 1.0
ND1 A:HIS80 2.3 28.3 1.0
CG A:ASP83 2.7 31.9 1.0
OD2 A:ASP83 2.8 33.7 1.0
CG A:HIS80 2.9 33.8 1.0
CE1 A:HIS80 3.0 29.3 1.0
CE1 A:HIS71 3.2 30.2 1.0
CG A:HIS63 3.2 29.9 1.0
CE1 A:HIS63 3.3 30.9 1.0
CG A:HIS71 3.3 25.8 1.0
CB A:HIS80 3.4 35.0 1.0
CB A:HIS63 3.4 29.0 1.0
CB A:HIS71 3.6 22.9 1.0
O A:LYS136 3.7 30.5 1.0
CD2 A:HIS80 3.8 44.1 1.0
NE2 A:HIS80 3.8 41.7 1.0
CA A:HIS71 4.0 26.4 1.0
CB A:ASP83 4.1 28.9 1.0
NE2 A:HIS71 4.3 32.7 1.0
CD2 A:HIS63 4.3 32.8 1.0
NE2 A:HIS63 4.4 33.7 1.0
CD2 A:HIS71 4.4 32.9 1.0
N A:HIS80 4.5 28.0 1.0
CA A:HIS80 4.6 28.8 1.0
CA A:ASP83 4.7 28.3 1.0
CD2 A:HIS46 4.7 28.4 1.0
N A:GLY72 4.8 32.9 1.0
C A:LYS136 4.8 26.5 1.0
N A:HIS71 4.9 26.1 1.0
C A:HIS71 4.9 26.5 1.0
CA A:HIS63 5.0 29.9 1.0
O A:HOH366 5.0 45.0 1.0

Zinc binding site 2 out of 12 in 8k33

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Zinc binding site 2 out of 12 in the SOD1 and NANOBODY1 Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of SOD1 and NANOBODY1 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Zn201

b:29.5
occ:1.00
OD1 C:ASP83 2.0 26.0 1.0
ND1 C:HIS80 2.3 28.0 1.0
ND1 C:HIS63 2.3 40.4 1.0
ND1 C:HIS71 2.3 31.7 1.0
CG C:ASP83 2.8 36.0 1.0
CG C:HIS63 2.9 33.7 1.0
CE1 C:HIS63 2.9 41.4 1.0
OD2 C:ASP83 2.9 31.5 1.0
CE1 C:HIS80 3.2 32.2 1.0
CG C:HIS80 3.2 35.7 1.0
CE1 C:HIS71 3.3 30.8 1.0
CG C:HIS71 3.3 34.3 1.0
CB C:HIS63 3.5 34.8 1.0
CB C:HIS80 3.5 32.5 1.0
CB C:HIS71 3.6 32.7 1.0
NE2 C:HIS63 3.7 39.3 1.0
CD2 C:HIS63 3.7 38.3 1.0
CA C:HIS71 4.0 34.1 1.0
O C:LYS136 4.0 36.8 1.0
CB C:ASP83 4.2 31.3 1.0
NE2 C:HIS80 4.3 37.0 1.0
CD2 C:HIS80 4.3 30.1 1.0
NE2 C:HIS71 4.4 35.8 1.0
CD2 C:HIS71 4.5 37.5 1.0
N C:HIS80 4.7 28.6 1.0
CA C:ASP83 4.7 33.1 1.0
CA C:HIS80 4.7 34.2 1.0
N C:GLY72 4.7 34.1 1.0
C C:HIS71 4.9 36.6 1.0
C C:LYS136 5.0 35.6 1.0
CA C:HIS63 5.0 33.3 1.0
N C:ASP83 5.0 30.9 1.0
N C:HIS71 5.0 37.2 1.0

Zinc binding site 3 out of 12 in 8k33

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Zinc binding site 3 out of 12 in the SOD1 and NANOBODY1 Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of SOD1 and NANOBODY1 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Zn201

b:33.1
occ:1.00
OD2 E:ASP83 1.9 31.9 1.0
ND1 E:HIS71 2.3 32.8 1.0
ND1 E:HIS80 2.3 36.1 1.0
ND1 E:HIS63 2.3 33.1 1.0
CG E:ASP83 2.8 39.1 1.0
OD1 E:ASP83 3.0 34.3 1.0
CE1 E:HIS80 3.0 32.3 1.0
CG E:HIS80 3.2 37.7 1.0
CE1 E:HIS71 3.2 24.4 1.0
CG E:HIS63 3.2 31.7 1.0
CG E:HIS71 3.3 32.9 1.0
CE1 E:HIS63 3.3 33.6 1.0
CB E:HIS63 3.4 32.2 1.0
CB E:HIS80 3.6 27.4 1.0
CB E:HIS71 3.6 33.2 1.0
O E:LYS136 3.9 40.4 1.0
CA E:HIS71 4.0 31.5 1.0
NE2 E:HIS80 4.1 38.0 1.0
CD2 E:HIS80 4.1 36.9 1.0
CB E:ASP83 4.2 34.6 1.0
NE2 E:HIS71 4.3 33.0 1.0
CD2 E:HIS63 4.3 35.0 1.0
NE2 E:HIS63 4.4 35.2 1.0
CD2 E:HIS71 4.4 33.9 1.0
CA E:ASP83 4.7 35.9 1.0
N E:HIS80 4.7 30.1 1.0
N E:GLY72 4.7 34.8 1.0
CA E:HIS80 4.7 29.0 1.0
N E:ASP83 4.9 36.1 1.0
C E:LYS136 4.9 32.2 1.0
C E:HIS71 4.9 36.5 1.0
O E:HOH341 4.9 45.5 1.0
CA E:HIS63 5.0 25.5 1.0
O E:GLY72 5.0 35.0 1.0
CD2 E:HIS46 5.0 31.5 1.0

Zinc binding site 4 out of 12 in 8k33

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Zinc binding site 4 out of 12 in the SOD1 and NANOBODY1 Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 4 of SOD1 and NANOBODY1 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
G:Zn201

b:30.8
occ:1.00
OD1 G:ASP83 2.0 30.6 1.0
ND1 G:HIS71 2.3 32.2 1.0
ND1 G:HIS80 2.3 34.4 1.0
ND1 G:HIS63 2.3 36.6 1.0
CG G:ASP83 2.7 32.4 1.0
OD2 G:ASP83 2.8 35.6 1.0
CE1 G:HIS80 3.1 36.5 1.0
CG G:HIS63 3.2 31.5 1.0
CG G:HIS71 3.2 36.1 1.0
CG G:HIS80 3.2 36.2 1.0
CE1 G:HIS71 3.3 34.3 1.0
CE1 G:HIS63 3.3 40.9 1.0
CB G:HIS63 3.4 28.5 1.0
CB G:HIS71 3.5 36.1 1.0
CB G:HIS80 3.6 34.9 1.0
O G:LYS136 3.8 42.9 1.0
CA G:HIS71 3.9 37.0 1.0
CB G:ASP83 4.2 31.1 1.0
NE2 G:HIS80 4.2 38.1 1.0
CD2 G:HIS80 4.3 39.3 1.0
CD2 G:HIS63 4.4 33.8 1.0
NE2 G:HIS71 4.4 35.8 1.0
NE2 G:HIS63 4.4 40.3 1.0
CD2 G:HIS71 4.4 35.5 1.0
N G:HIS80 4.7 38.9 1.0
C G:LYS136 4.7 34.5 1.0
CA G:ASP83 4.7 33.1 1.0
CA G:HIS80 4.8 35.4 1.0
N G:GLY72 4.8 37.3 1.0
C G:HIS71 4.9 40.1 1.0
N G:HIS71 4.9 37.0 1.0
CA G:HIS63 4.9 35.3 1.0
O G:HOH343 5.0 31.8 1.0
CD2 G:HIS46 5.0 33.7 1.0

Zinc binding site 5 out of 12 in 8k33

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Zinc binding site 5 out of 12 in the SOD1 and NANOBODY1 Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 5 of SOD1 and NANOBODY1 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Zn201

b:33.0
occ:1.00
OD1 I:ASP83 1.9 37.0 1.0
ND1 I:HIS63 2.3 39.5 1.0
ND1 I:HIS71 2.3 32.9 1.0
ND1 I:HIS80 2.3 37.5 1.0
CG I:ASP83 2.7 40.1 1.0
OD2 I:ASP83 2.8 36.2 1.0
CG I:HIS80 2.9 34.8 1.0
CE1 I:HIS80 3.0 36.8 1.0
CG I:HIS63 3.2 41.7 1.0
CE1 I:HIS71 3.2 32.0 1.0
CE1 I:HIS63 3.3 41.0 1.0
CG I:HIS71 3.3 38.7 1.0
CB I:HIS80 3.4 36.6 1.0
CB I:HIS63 3.4 36.0 1.0
CB I:HIS71 3.6 38.2 1.0
CD2 I:HIS80 3.7 47.3 1.0
NE2 I:HIS80 3.7 51.5 1.0
O I:LYS136 4.1 41.5 1.0
CA I:HIS71 4.1 36.9 1.0
CB I:ASP83 4.1 36.5 1.0
NE2 I:HIS71 4.3 36.2 1.0
CD2 I:HIS63 4.4 40.8 1.0
NE2 I:HIS63 4.4 43.2 1.0
CD2 I:HIS71 4.4 36.5 1.0
N I:HIS80 4.6 39.0 1.0
CA I:HIS80 4.6 33.2 1.0
CA I:ASP83 4.7 31.0 1.0
N I:GLY72 4.8 32.6 1.0
CA I:HIS63 5.0 36.0 1.0
N I:ASP83 5.0 39.2 1.0
C I:HIS71 5.0 37.3 1.0

Zinc binding site 6 out of 12 in 8k33

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Zinc binding site 6 out of 12 in the SOD1 and NANOBODY1 Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 6 of SOD1 and NANOBODY1 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
K:Zn201

b:31.6
occ:1.00
OD1 K:ASP83 1.9 25.1 1.0
ND1 K:HIS63 2.3 31.2 1.0
ND1 K:HIS80 2.3 25.3 1.0
ND1 K:HIS71 2.3 27.6 1.0
CG K:ASP83 2.6 31.5 1.0
OD2 K:ASP83 2.7 29.9 1.0
CG K:HIS80 3.2 29.8 1.0
CE1 K:HIS80 3.2 32.6 1.0
CG K:HIS63 3.2 31.0 1.0
CE1 K:HIS71 3.2 27.4 1.0
CG K:HIS71 3.3 28.4 1.0
CE1 K:HIS63 3.3 31.4 1.0
CB K:HIS63 3.4 26.7 1.0
CB K:HIS80 3.5 32.9 1.0
CB K:HIS71 3.5 28.6 1.0
O K:LYS136 3.7 33.2 1.0
CA K:HIS71 4.0 29.5 1.0
CB K:ASP83 4.1 31.1 1.0
NE2 K:HIS80 4.3 30.3 1.0
CD2 K:HIS80 4.3 30.7 1.0
NE2 K:HIS71 4.4 33.5 1.0
CD2 K:HIS63 4.4 31.5 1.0
NE2 K:HIS63 4.4 34.9 1.0
CD2 K:HIS71 4.4 32.8 1.0
CA K:ASP83 4.6 27.2 1.0
N K:HIS80 4.7 30.3 1.0
CA K:HIS80 4.7 30.6 1.0
N K:GLY72 4.8 27.9 1.0
C K:LYS136 4.8 27.7 1.0
N K:ASP83 4.9 30.8 1.0
C K:HIS71 4.9 32.0 1.0
CA K:HIS63 5.0 25.8 1.0
N K:HIS71 5.0 33.5 1.0

Zinc binding site 7 out of 12 in 8k33

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Zinc binding site 7 out of 12 in the SOD1 and NANOBODY1 Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 7 of SOD1 and NANOBODY1 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
L:Zn201

b:33.3
occ:1.00
CD2 L:HIS80 1.6 32.6 1.0
OD1 L:ASP83 2.0 34.3 1.0
ND1 L:HIS63 2.3 37.3 1.0
ND1 L:HIS71 2.3 32.2 1.0
NE2 L:HIS80 2.3 31.0 1.0
CG L:ASP83 2.7 35.3 1.0
CG L:HIS80 2.8 32.8 1.0
OD2 L:ASP83 2.9 31.5 1.0
CG L:HIS63 3.2 29.8 1.0
CE1 L:HIS71 3.2 34.3 1.0
CG L:HIS71 3.3 34.4 1.0
CE1 L:HIS63 3.3 38.2 1.0
CB L:HIS63 3.4 28.1 1.0
CE1 L:HIS80 3.5 31.3 1.0
CB L:HIS71 3.6 35.6 1.0
CB L:HIS80 3.7 31.9 1.0
ND1 L:HIS80 3.7 34.6 1.0
O L:LYS136 3.8 39.0 1.0
CA L:HIS71 4.0 34.1 1.0
CB L:ASP83 4.2 30.7 1.0
NE2 L:HIS71 4.4 40.0 1.0
CD2 L:HIS63 4.4 37.3 1.0
NE2 L:HIS63 4.4 35.5 1.0
CD2 L:HIS71 4.4 37.9 1.0
N L:HIS80 4.7 34.9 1.0
CA L:ASP83 4.7 31.6 1.0
N L:GLY72 4.8 33.8 1.0
C L:LYS136 4.8 41.8 1.0
CA L:HIS80 4.8 34.3 1.0
C L:HIS71 4.9 35.5 1.0
CA L:HIS63 4.9 34.8 1.0
N L:ASP83 4.9 35.8 1.0
CD2 L:HIS46 4.9 33.1 1.0
N L:HIS71 5.0 36.0 1.0
O L:HOH335 5.0 37.0 1.0

Zinc binding site 8 out of 12 in 8k33

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Zinc binding site 8 out of 12 in the SOD1 and NANOBODY1 Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 8 of SOD1 and NANOBODY1 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
N:Zn201

b:37.7
occ:1.00
OD1 N:ASP83 1.9 29.3 1.0
ND1 N:HIS80 2.3 40.5 1.0
ND1 N:HIS71 2.3 32.4 1.0
ND1 N:HIS63 2.3 39.2 1.0
CG N:ASP83 2.8 37.2 1.0
OD2 N:ASP83 3.0 45.1 1.0
CG N:HIS80 3.1 42.0 1.0
CG N:HIS71 3.2 36.6 1.0
CE1 N:HIS80 3.2 36.4 1.0
CG N:HIS63 3.2 34.3 1.0
CE1 N:HIS63 3.3 39.4 1.0
CE1 N:HIS71 3.3 32.8 1.0
CB N:HIS71 3.4 38.9 1.0
CB N:HIS63 3.4 35.4 1.0
CB N:HIS80 3.4 36.0 1.0
O N:LYS136 3.8 38.0 1.0
CA N:HIS71 3.8 37.6 1.0
CD2 N:HIS80 4.2 41.6 1.0
NE2 N:HIS80 4.2 41.6 1.0
CB N:ASP83 4.2 34.1 1.0
CD2 N:HIS71 4.3 34.0 1.0
CD2 N:HIS63 4.4 40.1 1.0
NE2 N:HIS71 4.4 35.0 1.0
NE2 N:HIS63 4.4 41.8 1.0
N N:HIS80 4.6 40.4 1.0
CA N:HIS80 4.6 36.5 1.0
N N:GLY72 4.6 43.2 1.0
CA N:ASP83 4.6 34.6 1.0
C N:HIS71 4.8 42.6 1.0
N N:HIS71 4.8 40.2 1.0
C N:LYS136 4.8 40.6 1.0
N N:ASP83 4.8 38.4 1.0
CA N:HIS63 4.9 42.6 1.0

Zinc binding site 9 out of 12 in 8k33

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Zinc binding site 9 out of 12 in the SOD1 and NANOBODY1 Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 9 of SOD1 and NANOBODY1 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
P:Zn201

b:37.9
occ:1.00
O P:HOH302 1.9 61.9 1.0
OD1 P:ASP83 1.9 35.1 1.0
ND1 P:HIS71 2.3 40.2 1.0
ND1 P:HIS63 2.3 46.2 1.0
ND1 P:HIS80 2.3 46.3 1.0
CG P:ASP83 2.6 37.0 1.0
OD2 P:ASP83 2.6 39.3 1.0
CG P:HIS80 2.8 41.8 1.0
CE1 P:HIS80 2.9 44.5 1.0
CE1 P:HIS71 3.0 38.8 1.0
CG P:HIS63 3.2 45.3 1.0
CB P:HIS80 3.3 39.3 1.0
CE1 P:HIS63 3.3 43.1 1.0
CB P:HIS63 3.4 43.5 1.0
CG P:HIS71 3.5 41.1 1.0
CD2 P:HIS80 3.6 57.3 1.0
NE2 P:HIS80 3.6 55.4 1.0
O P:LYS136 3.9 40.8 1.0
CB P:HIS71 4.0 43.4 1.0
CB P:ASP83 4.1 33.4 1.0
CA P:HIS71 4.2 43.0 1.0
NE2 P:HIS71 4.2 39.2 1.0
CD2 P:HIS63 4.4 45.0 1.0
NE2 P:HIS63 4.4 45.8 1.0
CD2 P:HIS71 4.5 40.2 1.0
N P:HIS80 4.5 46.0 1.0
CA P:HIS80 4.5 39.3 1.0
CA P:ASP83 4.6 40.9 1.0
N P:GLY72 4.9 36.8 1.0
CA P:HIS63 4.9 41.9 1.0
C P:LYS136 5.0 44.2 1.0
N P:ASP83 5.0 38.3 1.0

Zinc binding site 10 out of 12 in 8k33

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Zinc binding site 10 out of 12 in the SOD1 and NANOBODY1 Complex


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 10 of SOD1 and NANOBODY1 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
Y:Zn201

b:49.2
occ:1.00
CD2 Y:HIS80 1.5 44.9 1.0
OD1 Y:ASP83 2.1 46.3 1.0
ND1 Y:HIS71 2.3 47.2 1.0
ND1 Y:HIS63 2.3 47.4 1.0
NE2 Y:HIS80 2.3 45.8 1.0
CG Y:HIS80 2.7 46.2 1.0
CG Y:ASP83 2.8 49.3 1.0
OD2 Y:ASP83 2.8 50.2 1.0
CE1 Y:HIS71 3.2 45.5 1.0
CE1 Y:HIS63 3.2 48.6 1.0
CG Y:HIS63 3.3 51.9 1.0
CG Y:HIS71 3.3 46.5 1.0
CE1 Y:HIS80 3.5 44.4 1.0
CB Y:HIS80 3.5 42.2 1.0
CB Y:HIS63 3.6 47.0 1.0
ND1 Y:HIS80 3.6 45.3 1.0
CB Y:HIS71 3.7 46.4 1.0
O Y:LYS136 3.7 46.8 1.0
CA Y:HIS71 4.0 50.5 1.0
CB Y:ASP83 4.2 46.1 1.0
NE2 Y:HIS71 4.3 48.8 1.0
NE2 Y:HIS63 4.4 50.4 1.0
CD2 Y:HIS71 4.4 49.4 1.0
CD2 Y:HIS63 4.4 50.6 1.0
N Y:HIS80 4.6 49.1 1.0
N Y:GLY72 4.7 47.1 1.0
CA Y:HIS80 4.7 47.3 1.0
CA Y:ASP83 4.8 41.3 1.0
C Y:LYS136 4.8 44.2 1.0
C Y:HIS71 4.9 46.7 1.0
N Y:HIS71 5.0 50.0 1.0
N Y:ASP83 5.0 46.0 1.0
CD2 Y:HIS46 5.0 47.8 1.0

Reference:

S.Cheng, S.Cheng. N/A N/A.
Page generated: Thu Oct 31 08:30:37 2024

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