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Copper in PDB 6vbs: The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit.

Enzymatic activity of The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit.

All present enzymatic activity of The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit.:
1.15.1.1;

Protein crystallography data

The structure of The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit., PDB code: 6vbs was solved by K.A.Satyshur, K.T.Forest, P.W.Newhouse, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 35.88 / 1.70
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 152.838, 69.474, 95.288, 90, 116.89, 90
R / Rfree (%) 17.9 / 21.9

Other elements in 6vbs:

The structure of The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit. also contains other interesting chemical elements:

Zinc (Zn) 6 atoms

Copper Binding Sites:

The binding sites of Copper atom in the The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit. (pdb code 6vbs). This binding sites where shown within 5.0 Angstroms radius around Copper atom.
In total 6 binding sites of Copper where determined in the The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit., PDB code: 6vbs:
Jump to Copper binding site number: 1; 2; 3; 4; 5; 6;

Copper binding site 1 out of 6 in 6vbs

Go back to Copper Binding Sites List in 6vbs
Copper binding site 1 out of 6 in the The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit.


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 1 of The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cu201

b:35.2
occ:1.00
NE2 A:HIS130 1.9 19.6 1.0
ND1 A:HIS49 2.1 18.0 1.0
NE2 A:HIS51 2.1 15.1 1.0
HE2 A:HIS74 2.6 24.5 1.0
HB2 A:HIS49 2.7 19.8 1.0
CD2 A:HIS130 2.9 18.3 1.0
CE1 A:HIS130 2.9 20.1 1.0
CE1 A:HIS51 3.0 19.7 1.0
CG A:HIS49 3.0 18.6 1.0
NE2 A:HIS74 3.1 20.5 1.0
HD2 A:HIS130 3.1 21.9 1.0
HB3 A:MET128 3.1 18.4 1.0
CE1 A:HIS49 3.1 17.7 1.0
HE1 A:HIS51 3.1 23.7 1.0
CD2 A:HIS51 3.1 17.9 1.0
HE1 A:HIS130 3.2 24.1 1.0
CB A:HIS49 3.3 16.5 1.0
HE1 A:HIS49 3.3 21.2 1.0
HD2 A:HIS51 3.4 21.4 1.0
HD2 A:HIS74 3.4 24.6 1.0
HG2 A:MET128 3.4 21.9 1.0
CD2 A:HIS74 3.5 20.6 1.0
CB A:MET128 3.9 15.4 1.0
HB3 A:HIS49 3.9 19.8 1.0
O A:HOH413 4.0 25.1 1.0
CE1 A:HIS74 4.0 18.4 1.0
ND1 A:HIS130 4.0 17.0 1.0
CG A:HIS130 4.0 18.9 1.0
CG A:MET128 4.0 18.2 1.0
H A:HIS49 4.1 14.5 1.0
ND1 A:HIS51 4.1 12.5 1.0
CD2 A:HIS49 4.1 18.8 1.0
NE2 A:HIS49 4.2 14.8 1.0
HB2 A:MET128 4.2 18.4 1.0
CG A:HIS51 4.2 16.3 1.0
HG3 A:MET128 4.3 21.9 1.0
O A:HOH368 4.3 19.5 1.0
CA A:HIS49 4.3 14.5 1.0
HE1 A:HIS74 4.3 22.0 1.0
N A:HIS49 4.3 12.1 1.0
CG A:HIS74 4.5 16.4 1.0
O A:HIS49 4.8 10.4 1.0
O A:MET128 4.8 9.8 1.0
ND1 A:HIS74 4.8 15.1 1.0
C A:HIS49 4.8 13.0 1.0
HD1 A:HIS130 4.8 20.4 1.0
HG2 A:ARG149 4.9 21.3 1.0
HD1 A:HIS51 4.9 15.0 1.0
HE2 A:HIS49 4.9 17.7 1.0
HD2 A:HIS49 5.0 22.6 1.0

Copper binding site 2 out of 6 in 6vbs

Go back to Copper Binding Sites List in 6vbs
Copper binding site 2 out of 6 in the The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit.


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 2 of The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cu202

b:40.0
occ:1.00
NE2 B:HIS130 2.0 17.0 1.0
ND1 B:HIS49 2.0 14.6 1.0
NE2 B:HIS51 2.1 16.5 1.0
HB2 B:HIS49 2.6 22.2 1.0
HE2 B:HIS74 2.8 20.2 1.0
CE1 B:HIS51 2.9 19.4 1.0
CE1 B:HIS130 2.9 19.8 1.0
CG B:HIS49 2.9 16.2 1.0
HE1 B:HIS51 3.0 23.3 1.0
CD2 B:HIS130 3.0 17.2 1.0
CE1 B:HIS49 3.0 16.8 1.0
HE1 B:HIS130 3.1 23.7 1.0
HB3 B:MET128 3.1 19.0 1.0
NE2 B:HIS74 3.2 16.9 1.0
CB B:HIS49 3.2 18.5 1.0
HD2 B:HIS130 3.2 20.7 1.0
CD2 B:HIS51 3.2 17.8 1.0
HE1 B:HIS49 3.3 20.1 1.0
HD2 B:HIS74 3.4 22.5 1.0
CD2 B:HIS74 3.5 18.8 1.0
HG2 B:MET128 3.5 22.9 1.0
HD2 B:HIS51 3.5 21.3 1.0
O B:HOH417 3.8 19.4 1.0
HB3 B:HIS49 3.8 22.2 1.0
CB B:MET128 3.9 15.8 1.0
ND1 B:HIS130 4.0 17.5 1.0
CG B:HIS130 4.1 16.3 1.0
ND1 B:HIS51 4.1 13.6 1.0
CD2 B:HIS49 4.1 17.9 1.0
CE1 B:HIS74 4.1 17.1 1.0
NE2 B:HIS49 4.1 14.4 1.0
CG B:MET128 4.1 19.1 1.0
H B:HIS49 4.1 14.0 1.0
O B:HOH408 4.1 16.8 1.0
HB2 B:MET128 4.2 19.0 1.0
CG B:HIS51 4.3 17.4 1.0
CA B:HIS49 4.3 15.4 1.0
N B:HIS49 4.3 11.7 1.0
HG3 B:MET128 4.4 22.9 1.0
HE1 B:HIS74 4.5 20.5 1.0
CG B:HIS74 4.5 16.9 1.0
HD1 B:HIS130 4.8 21.0 1.0
O B:HIS49 4.8 11.4 1.0
C B:HIS49 4.8 13.9 1.0
O B:MET128 4.8 12.5 1.0
HD1 B:HIS51 4.8 16.3 1.0
ND1 B:HIS74 4.8 12.2 1.0
HE2 B:HIS49 4.9 17.2 1.0
HD2 B:HIS49 4.9 21.5 1.0
HG2 B:ARG149 4.9 19.3 1.0

Copper binding site 3 out of 6 in 6vbs

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Copper binding site 3 out of 6 in the The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit.


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 3 of The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit. within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cu202

b:39.2
occ:1.00
ND1 C:HIS49 2.2 15.9 1.0
NE2 C:HIS51 2.3 14.6 1.0
HB2 C:HIS49 2.7 20.9 1.0
HB3 C:MET128 2.9 22.9 1.0
HE2 C:HIS74 2.9 18.9 1.0
NE2 C:HIS130 3.1 17.1 1.0
CG C:HIS49 3.1 17.5 1.0
HD2 C:HIS130 3.1 29.7 1.0
CE1 C:HIS51 3.2 18.5 1.0
CE1 C:HIS49 3.2 20.9 1.0
O C:HOH345 3.2 27.2 1.0
HE1 C:HIS51 3.3 22.2 1.0
HG2 C:MET128 3.3 30.4 1.0
NE2 C:HIS74 3.3 15.7 1.0
CB C:HIS49 3.3 17.4 1.0
CD2 C:HIS51 3.3 17.8 1.0
HE1 C:HIS49 3.4 25.1 1.0
CD2 C:HIS130 3.4 24.8 1.0
HD2 C:HIS51 3.5 21.4 1.0
HD2 C:HIS74 3.6 23.0 1.0
CD2 C:HIS74 3.7 19.2 1.0
CB C:MET128 3.7 19.1 1.0
CG C:MET128 3.9 25.3 1.0
H C:HIS49 4.0 14.8 1.0
HB3 C:HIS49 4.0 20.9 1.0
HB2 C:MET128 4.1 22.9 1.0
CE1 C:HIS74 4.2 19.7 1.0
CD2 C:HIS49 4.2 20.4 1.0
NE2 C:HIS49 4.3 16.8 1.0
HG3 C:MET128 4.3 30.4 1.0
N C:HIS49 4.3 12.3 1.0
CA C:HIS49 4.3 13.8 1.0
CE1 C:HIS130 4.3 20.9 1.0
ND1 C:HIS51 4.3 16.0 1.0
CG C:HIS51 4.4 20.1 1.0
HE1 C:HIS74 4.5 23.6 1.0
O C:HIS49 4.6 8.6 1.0
O C:MET128 4.6 8.6 1.0
CG C:HIS74 4.7 18.6 1.0
HE1 C:HIS130 4.7 25.1 1.0
C C:HIS49 4.7 16.4 1.0
CG C:HIS130 4.8 25.3 1.0
HE3 C:MET128 4.8 35.4 1.0
HG2 C:ARG149 4.9 40.7 1.0
C C:MET128 4.9 16.3 1.0
CA C:MET128 4.9 16.3 1.0
ND1 C:HIS74 5.0 12.6 1.0

Copper binding site 4 out of 6 in 6vbs

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Copper binding site 4 out of 6 in the The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit.


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 4 of The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit. within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cu202

b:42.1
occ:1.00
ND1 D:HIS49 2.2 16.2 1.0
NE2 D:HIS51 2.3 18.0 1.0
NE2 D:HIS130 2.3 30.5 1.0
HB2 D:HIS49 2.9 19.4 1.0
HD2 D:HIS130 2.9 33.8 1.0
HE2 D:HIS74 3.0 20.6 1.0
CD2 D:HIS130 3.0 28.2 1.0
HB3 D:MET128 3.0 22.8 1.0
O D:HOH302 3.0 24.5 1.0
HG2 D:MET128 3.1 29.7 1.0
CE1 D:HIS51 3.1 20.4 1.0
HE1 D:HIS51 3.1 24.5 1.0
CE1 D:HIS49 3.2 19.4 1.0
CG D:HIS49 3.2 16.6 1.0
HE1 D:HIS49 3.3 23.3 1.0
CD2 D:HIS51 3.4 19.5 1.0
NE2 D:HIS74 3.4 17.2 1.0
CE1 D:HIS130 3.5 24.1 1.0
CB D:HIS49 3.5 16.2 1.0
HD2 D:HIS51 3.7 23.4 1.0
CG D:MET128 3.8 24.7 1.0
CB D:MET128 3.8 19.0 1.0
HD2 D:HIS74 3.8 22.8 1.0
HE1 D:HIS130 3.8 28.9 1.0
CD2 D:HIS74 3.9 19.0 1.0
HG3 D:MET128 4.1 29.7 1.0
H D:HIS49 4.1 11.8 1.0
HB3 D:HIS49 4.2 19.4 1.0
HB2 D:MET128 4.2 22.8 1.0
CG D:HIS130 4.2 25.2 1.0
ND1 D:HIS51 4.3 18.8 1.0
NE2 D:HIS49 4.3 15.5 1.0
CD2 D:HIS49 4.3 20.7 1.0
CE1 D:HIS74 4.4 21.4 1.0
N D:HIS49 4.4 9.8 1.0
CA D:HIS49 4.5 13.8 1.0
ND1 D:HIS130 4.5 29.6 1.0
CG D:HIS51 4.5 19.2 1.0
HG2 D:ARG149 4.6 35.6 1.0
O D:MET128 4.6 8.7 1.0
O4 D:SO4203 4.6 37.0 1.0
HE3 D:MET128 4.6 27.2 1.0
HE1 D:HIS74 4.6 25.6 1.0
O D:HIS49 4.7 10.3 1.0
O D:HOH320 4.7 31.4 1.0
C D:MET128 4.9 16.3 1.0
C D:HIS49 4.9 15.6 1.0
CA D:MET128 4.9 19.1 1.0
CG D:HIS74 4.9 13.0 1.0

Copper binding site 5 out of 6 in 6vbs

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Copper binding site 5 out of 6 in the The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit.


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 5 of The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit. within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Cu201

b:46.5
occ:1.00
NE2 E:HIS130 1.9 28.8 1.0
NE2 E:HIS51 2.0 18.9 1.0
ND1 E:HIS49 2.2 20.3 1.0
HB2 E:HIS49 2.7 28.3 1.0
CD2 E:HIS130 2.8 25.8 1.0
CE1 E:HIS51 2.9 26.1 1.0
HB3 E:MET128 2.9 25.5 1.0
HD2 E:HIS130 2.9 30.9 1.0
HE2 E:HIS74 2.9 30.7 1.0
HE1 E:HIS51 3.0 31.3 1.0
CE1 E:HIS130 3.0 28.3 1.0
CD2 E:HIS51 3.1 22.4 1.0
CG E:HIS49 3.1 21.1 1.0
CE1 E:HIS49 3.2 25.9 1.0
HG2 E:MET128 3.3 24.4 1.0
NE2 E:HIS74 3.3 25.6 1.0
HE1 E:HIS130 3.3 33.9 1.0
HD2 E:HIS51 3.3 26.8 1.0
HE1 E:HIS49 3.4 31.0 1.0
CB E:HIS49 3.4 23.6 1.0
HD2 E:HIS74 3.5 33.4 1.0
CD2 E:HIS74 3.6 27.9 1.0
CB E:MET128 3.7 21.2 1.0
O E:HOH403 3.9 33.5 1.0
CG E:MET128 3.9 20.3 1.0
CG E:HIS130 4.0 26.4 1.0
HB2 E:MET128 4.0 25.5 1.0
ND1 E:HIS51 4.0 19.2 1.0
H E:HIS49 4.0 19.1 1.0
ND1 E:HIS130 4.1 25.8 1.0
HB3 E:HIS49 4.1 28.3 1.0
CG E:HIS51 4.2 22.0 1.0
HG3 E:MET128 4.2 24.4 1.0
CE1 E:HIS74 4.3 33.3 1.0
NE2 E:HIS49 4.3 19.5 1.0
CD2 E:HIS49 4.3 20.5 1.0
N E:HIS49 4.3 15.9 1.0
CA E:HIS49 4.3 24.0 1.0
O E:HOH317 4.6 28.5 1.0
O E:HIS49 4.6 13.8 1.0
HE1 E:HIS74 4.6 39.9 1.0
O E:MET128 4.7 12.9 1.0
CG E:HIS74 4.7 28.7 1.0
C E:HIS49 4.7 20.0 1.0
HG2 E:ARG149 4.8 24.9 1.0
HD1 E:HIS51 4.8 23.0 1.0
HE3 E:MET128 4.8 34.1 1.0
HD1 E:HIS130 4.9 30.9 1.0
CA E:MET128 4.9 18.6 1.0
C E:MET128 5.0 17.3 1.0
ND1 E:HIS74 5.0 24.1 1.0

Copper binding site 6 out of 6 in 6vbs

Go back to Copper Binding Sites List in 6vbs
Copper binding site 6 out of 6 in the The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit.


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 6 of The C2 Crystal Form of Sodci Superoxide Dismutase at 1.7 A Resolution with 6 Molecules in the Asymmetric Unit. within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Cu202

b:44.2
occ:1.00
NE2 F:HIS130 1.8 26.4 1.0
ND1 F:HIS49 2.1 18.3 1.0
NE2 F:HIS51 2.1 20.7 1.0
HB2 F:HIS49 2.6 23.1 1.0
HE2 F:HIS74 2.7 25.9 1.0
CE1 F:HIS130 2.8 30.1 1.0
CD2 F:HIS130 2.9 26.0 1.0
HE1 F:HIS130 2.9 36.0 1.0
CE1 F:HIS51 2.9 31.6 1.0
CG F:HIS49 2.9 19.3 1.0
HE1 F:HIS51 3.0 37.9 1.0
CE1 F:HIS49 3.1 23.2 1.0
NE2 F:HIS74 3.1 21.6 1.0
HD2 F:HIS130 3.2 31.2 1.0
HB3 F:MET128 3.2 31.5 1.0
CB F:HIS49 3.2 19.2 1.0
CD2 F:HIS51 3.2 25.1 1.0
HE1 F:HIS49 3.3 27.8 1.0
HD2 F:HIS74 3.4 30.5 1.0
CD2 F:HIS74 3.5 25.5 1.0
HD2 F:HIS51 3.5 30.1 1.0
HG2 F:MET128 3.5 29.7 1.0
HB3 F:HIS49 3.8 23.1 1.0
ND1 F:HIS130 3.9 19.4 1.0
CG F:HIS130 4.0 19.2 1.0
CB F:MET128 4.0 26.3 1.0
CE1 F:HIS74 4.0 23.3 1.0
O F:HOH370 4.1 26.6 1.0
CD2 F:HIS49 4.1 19.1 1.0
ND1 F:HIS51 4.1 21.5 1.0
NE2 F:HIS49 4.1 15.2 1.0
O F:HOH391 4.1 27.2 1.0
CG F:MET128 4.2 24.7 1.0
H F:HIS49 4.2 17.0 1.0
CG F:HIS51 4.3 18.7 1.0
CA F:HIS49 4.3 17.8 1.0
HB2 F:MET128 4.3 31.5 1.0
HE1 F:HIS74 4.4 28.0 1.0
N F:HIS49 4.4 14.2 1.0
CG F:HIS74 4.5 20.1 1.0
HG3 F:MET128 4.5 29.7 1.0
HD1 F:HIS130 4.6 23.3 1.0
O F:HIS49 4.8 13.8 1.0
ND1 F:HIS74 4.8 16.8 1.0
C F:HIS49 4.8 15.6 1.0
HD1 F:HIS51 4.9 25.8 1.0
HG2 F:ARG149 4.9 34.3 1.0
HD2 F:HIS49 4.9 22.9 1.0
HE2 F:HIS49 4.9 18.2 1.0
O F:MET128 4.9 13.1 1.0

Reference:

P.W.Newhouse, K.A.Satyshur, J.M.Slauch, K.T.Forest. Structure and Muropeptide Binding of the Virulence Factor Superoxide Dismutase C1 From Salmonella Typhimurium To Be Published.
Page generated: Mon Jul 14 07:21:02 2025

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