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Iron in PDB 2eil: Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State

Enzymatic activity of Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State

All present enzymatic activity of Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State:
1.9.3.1;

Protein crystallography data

The structure of Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State, PDB code: 2eil was solved by K.Muramoto, K.Hirata, K.Shinzawa-Itoh, S.Yoko-O, E.Yamashita, H.Aoyama, T.Tsukihara, S.Yoshikawa, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 40.00 / 2.10
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 183.379, 205.898, 178.182, 90.00, 90.00, 90.00
R / Rfree (%) 19.9 / 23.1

Other elements in 2eil:

The structure of Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State also contains other interesting chemical elements:

Magnesium (Mg) 2 atoms
Zinc (Zn) 2 atoms
Cadmium (Cd) 3 atoms
Copper (Cu) 6 atoms
Sodium (Na) 2 atoms

Iron Binding Sites:

The binding sites of Iron atom in the Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State (pdb code 2eil). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 4 binding sites of Iron where determined in the Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State, PDB code: 2eil:
Jump to Iron binding site number: 1; 2; 3; 4;

Iron binding site 1 out of 4 in 2eil

Go back to Iron Binding Sites List in 2eil
Iron binding site 1 out of 4 in the Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe515

b:20.1
occ:1.00
 FE A:HEA515 0.0 20.1 1.0
NE2 A:HIS378 1.8 17.1 1.0
NB A:HEA515 1.9 21.1 1.0
NE2 A:HIS61 1.9 15.7 1.0
NC A:HEA515 2.0 25.0 1.0
ND A:HEA515 2.0 23.0 1.0
NA A:HEA515 2.1 24.8 1.0
CE1 A:HIS378 2.7 21.0 1.0
CE1 A:HIS61 3.0 18.2 1.0
C1B A:HEA515 3.0 24.1 1.0
C4C A:HEA515 3.0 25.2 1.0
C4B A:HEA515 3.0 23.7 1.0
CD2 A:HIS378 3.0 18.4 1.0
CD2 A:HIS61 3.0 19.0 1.0
C1C A:HEA515 3.1 24.1 1.0
C4A A:HEA515 3.1 23.4 1.0
C1D A:HEA515 3.1 25.7 1.0
C4D A:HEA515 3.1 25.9 1.0
C1A A:HEA515 3.1 22.9 1.0
CHB A:HEA515 3.4 21.5 1.0
CHD A:HEA515 3.5 21.8 1.0
CHC A:HEA515 3.5 23.8 1.0
CHA A:HEA515 3.5 23.1 1.0
ND1 A:HIS378 3.9 21.0 1.0
CG A:HIS378 4.1 18.1 1.0
ND1 A:HIS61 4.1 16.7 1.0
CG A:HIS61 4.2 17.6 1.0
C2B A:HEA515 4.2 20.3 1.0
C3B A:HEA515 4.3 20.9 1.0
C3C A:HEA515 4.3 23.1 1.0
C2C A:HEA515 4.3 24.5 1.0
C3D A:HEA515 4.3 26.7 1.0
C3A A:HEA515 4.3 25.3 1.0
C2D A:HEA515 4.3 22.1 1.0
C2A A:HEA515 4.3 25.1 1.0
CE2 A:PHE377 4.9 19.6 1.0

Iron binding site 2 out of 4 in 2eil

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Iron binding site 2 out of 4 in the Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe516

b:19.6
occ:1.00
 FE A:HEA516 0.0 19.6 1.0
ND A:HEA516 1.9 21.4 1.0
NB A:HEA516 1.9 17.1 1.0
NE2 A:HIS376 2.0 18.1 1.0
NA A:HEA516 2.0 20.6 1.0
NC A:HEA516 2.1 21.7 1.0
CE1 A:HIS376 2.8 18.8 1.0
C4D A:HEA516 3.0 22.2 1.0
C4B A:HEA516 3.0 22.6 1.0
C1D A:HEA516 3.0 22.2 1.0
C1B A:HEA516 3.0 23.5 1.0
C1A A:HEA516 3.0 17.1 1.0
C4A A:HEA516 3.1 20.5 1.0
C1C A:HEA516 3.1 19.5 1.0
C4C A:HEA516 3.2 18.6 1.0
CD2 A:HIS376 3.2 22.8 1.0
CHA A:HEA516 3.4 18.0 1.0
CHC A:HEA516 3.4 21.5 1.0
CHB A:HEA516 3.4 22.9 1.0
CHD A:HEA516 3.5 16.3 1.0
ND1 A:HIS376 4.1 21.8 1.0
C3D A:HEA516 4.2 19.6 1.0
C2D A:HEA516 4.2 21.2 1.0
C2B A:HEA516 4.2 19.2 1.0
C3B A:HEA516 4.2 21.4 1.0
CG A:HIS376 4.3 18.6 1.0
C2A A:HEA516 4.3 19.5 1.0
C3A A:HEA516 4.3 18.5 1.0
C2C A:HEA516 4.4 22.8 1.0
C3C A:HEA516 4.4 21.3 1.0
CU A:CU517 4.8 22.5 1.0

Iron binding site 3 out of 4 in 2eil

Go back to Iron Binding Sites List in 2eil
Iron binding site 3 out of 4 in the Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 3 of Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State within 5.0Å range:
probe atom residue distance (Å) B Occ
N:Fe515

b:27.3
occ:1.00
 FE N:HEA515 0.0 27.3 1.0
ND N:HEA515 2.0 30.5 1.0
NE2 N:HIS378 2.0 21.2 1.0
NA N:HEA515 2.0 28.6 1.0
NC N:HEA515 2.0 27.1 1.0
NE2 N:HIS61 2.0 26.7 1.0
NB N:HEA515 2.0 29.9 1.0
CE1 N:HIS378 2.9 22.9 1.0
CD2 N:HIS61 3.0 26.8 1.0
C1B N:HEA515 3.0 28.5 1.0
C4D N:HEA515 3.0 29.3 1.0
C4C N:HEA515 3.0 30.5 1.0
C4A N:HEA515 3.0 28.9 1.0
C1D N:HEA515 3.0 30.9 1.0
CE1 N:HIS61 3.0 31.8 1.0
C1A N:HEA515 3.1 30.6 1.0
C1C N:HEA515 3.1 27.0 1.0
C4B N:HEA515 3.1 29.1 1.0
CD2 N:HIS378 3.1 22.0 1.0
CHB N:HEA515 3.4 26.3 1.0
CHA N:HEA515 3.4 30.2 1.0
CHD N:HEA515 3.4 27.2 1.0
CHC N:HEA515 3.5 25.9 1.0
ND1 N:HIS378 4.1 20.7 1.0
CG N:HIS61 4.1 28.4 1.0
ND1 N:HIS61 4.2 24.5 1.0
CG N:HIS378 4.2 19.7 1.0
C2B N:HEA515 4.3 30.0 1.0
C2A N:HEA515 4.3 28.0 1.0
C3D N:HEA515 4.3 28.5 1.0
C3A N:HEA515 4.3 29.6 1.0
C2D N:HEA515 4.3 28.9 1.0
C3C N:HEA515 4.3 26.6 1.0
C2C N:HEA515 4.3 28.1 1.0
C3B N:HEA515 4.3 29.5 1.0
CE2 N:PHE377 4.9 22.3 1.0

Iron binding site 4 out of 4 in 2eil

Go back to Iron Binding Sites List in 2eil
Iron binding site 4 out of 4 in the Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 4 of Cadmium Ion Binding Structure of Bovine Heart Cytochrome C Oxidase in the Fully Oxidized State within 5.0Å range:
probe atom residue distance (Å) B Occ
N:Fe516

b:24.1
occ:1.00
 FE N:HEA516 0.0 24.1 1.0
ND N:HEA516 1.8 24.3 1.0
NB N:HEA516 1.9 24.1 1.0
NA N:HEA516 2.1 25.4 1.0
NC N:HEA516 2.1 23.6 1.0
NE2 N:HIS376 2.1 26.2 1.0
C4D N:HEA516 2.9 24.1 1.0
C1D N:HEA516 2.9 26.4 1.0
C4B N:HEA516 3.0 23.6 1.0
C1B N:HEA516 3.0 25.9 1.0
C1A N:HEA516 3.1 24.1 1.0
CE1 N:HIS376 3.1 29.3 1.0
C1C N:HEA516 3.1 24.4 1.0
CD2 N:HIS376 3.1 27.6 1.0
C4C N:HEA516 3.1 27.8 1.0
C4A N:HEA516 3.1 26.3 1.0
CHA N:HEA516 3.4 22.8 1.0
CHC N:HEA516 3.4 23.6 1.0
CHD N:HEA516 3.5 26.5 1.0
CHB N:HEA516 3.5 26.2 1.0
C3D N:HEA516 4.1 23.2 1.0
C2D N:HEA516 4.2 22.4 1.0
ND1 N:HIS376 4.2 28.6 1.0
C3B N:HEA516 4.3 23.3 1.0
CG N:HIS376 4.3 24.1 1.0
C2B N:HEA516 4.3 21.4 1.0
C2A N:HEA516 4.3 24.5 1.0
C3A N:HEA516 4.4 20.5 1.0
C2C N:HEA516 4.4 23.1 1.0
C3C N:HEA516 4.4 27.4 1.0
CU N:CU517 4.9 27.1 1.0

Reference:

K.Muramoto, K.Hirata, K.Shinzawa-Itoh, S.Yoko-O, E.Yamashita, H.Aoyama, T.Tsukihara, S.Yoshikawa. A Histidine Residue Acting As A Controlling Site For Dioxygen Reduction and Proton Pumping By Cytochrome C Oxidase Proc.Natl.Acad.Sci.Usa V. 104 7881 2007.
ISSN: ISSN 0027-8424
PubMed: 17470809
DOI: 10.1073/PNAS.0610031104
Page generated: Sat Aug 3 21:07:45 2024

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