Atomistry » Iron » PDB 8ca4-8csp » 8cmw
Atomistry »
  Iron »
    PDB 8ca4-8csp »
      8cmw »

Iron in PDB 8cmw: A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans

Enzymatic activity of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans

All present enzymatic activity of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans:
1.2.5.3; 2.3.1.169;

Protein crystallography data

The structure of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans, PDB code: 8cmw was solved by J.Ruickoldt, J.Jeoung, F.Lennartz, H.Dobbek, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 22.94 / 2.60
Space group P 61 2 2
Cell size a, b, c (Å), α, β, γ (°) 141.72, 141.72, 290.263, 90, 90, 120
R / Rfree (%) 20.3 / 26.4

Other elements in 8cmw:

The structure of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans also contains other interesting chemical elements:

Nickel (Ni) 3 atoms
Sodium (Na) 1 atom

Iron Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 14;

Binding sites:

The binding sites of Iron atom in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans (pdb code 8cmw). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 14 binding sites of Iron where determined in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans, PDB code: 8cmw:
Jump to Iron binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Iron binding site 1 out of 14 in 8cmw

Go back to Iron Binding Sites List in 8cmw
Iron binding site 1 out of 14 in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe701

b:45.3
occ:0.63
FE1 A:RQM701 0.0 45.3 0.6
S3 A:RQM701 2.3 49.9 0.9
SG A:CYS354 2.3 57.5 1.0
S4 A:RQM701 2.3 46.2 0.8
S2 A:RQM701 2.4 54.9 1.0
FE3 A:RQM701 2.6 40.6 0.8
FE4 A:RQM701 2.7 47.4 1.0
FE2 A:RQM701 3.2 38.2 1.0
CB A:CYS354 3.3 50.0 1.0
S1 A:RQM701 3.8 48.9 0.8
NI A:RQM701 3.9 46.3 0.5
CE1 A:HIS282 4.2 51.6 1.0
NE2 A:HIS282 4.2 51.3 1.0
O A:OH704 4.2 46.5 1.0
NZ A:LYS583 4.4 53.7 1.0
OG A:SER581 4.4 34.3 1.0
SG A:CYS467 4.4 35.3 1.0
O A:DOD805 4.5 43.1 0.4
CE A:LYS583 4.5 55.1 1.0
CE A:MET580 4.7 43.9 1.0
CB A:SER581 4.7 36.9 1.0
CA A:CYS354 4.8 53.7 1.0
SG A:CYS497 4.8 50.5 1.0

Iron binding site 2 out of 14 in 8cmw

Go back to Iron Binding Sites List in 8cmw
Iron binding site 2 out of 14 in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe701

b:38.2
occ:1.00
FE2 A:RQM701 0.0 38.2 1.0
O A:DOD805 1.9 43.1 0.4
NE2 A:HIS282 2.2 51.3 1.0
SG A:CYS316 2.3 43.2 1.0
S3 A:RQM701 2.3 49.9 0.9
NI A:RQM701 2.4 46.3 0.5
S4 A:RQM701 2.9 46.2 0.8
SG D:CYS1 3.0 47.1 0.4
CE1 A:HIS282 3.0 51.6 1.0
FE1 A:RQM701 3.2 45.3 0.6
CD2 A:HIS282 3.3 53.0 1.0
CB A:CYS316 3.3 44.7 1.0
CB D:CYS1 3.4 45.7 0.4
CB A:CYS546 3.5 45.7 0.3
S1 A:RQM701 3.7 48.9 0.8
FE4 A:RQM701 3.7 47.4 1.0
CB A:CYS546 3.7 45.6 0.3
SG A:CYS546 3.8 45.6 0.3
SG A:CYS546 4.0 42.6 0.3
CE A:LYS583 4.1 55.1 1.0
O A:OH704 4.1 46.5 1.0
FE3 A:RQM701 4.2 40.6 0.8
ND1 A:HIS282 4.2 48.7 1.0
CG A:HIS282 4.3 53.8 1.0
CA A:CYS316 4.4 47.4 1.0
N A:CYS316 4.5 45.8 1.0
NZ A:LYS583 4.6 53.7 1.0
N D:CYS1 4.6 48.9 0.4
N A:CYS546 4.7 48.1 0.3
SG A:CYS354 4.7 57.5 1.0
CA D:CYS1 4.7 46.6 0.4
N A:CYS546 4.7 46.0 0.3
CA A:CYS546 4.7 46.7 0.3
CA A:CYS546 4.8 47.1 0.3
S2 A:RQM701 5.0 54.9 1.0

Iron binding site 3 out of 14 in 8cmw

Go back to Iron Binding Sites List in 8cmw
Iron binding site 3 out of 14 in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 3 of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe701

b:40.6
occ:0.78
FE3 A:RQM701 0.0 40.6 0.8
S4 A:RQM701 2.2 46.2 0.8
S1 A:RQM701 2.2 48.9 0.8
S2 A:RQM701 2.3 54.9 1.0
SG A:CYS467 2.5 35.3 1.0
FE1 A:RQM701 2.6 45.3 0.6
O A:OH704 2.6 46.5 1.0
FE4 A:RQM701 2.7 47.4 1.0
NI A:RQM701 3.3 46.3 0.5
CB A:CYS467 3.4 54.7 1.0
CA A:CYS467 3.7 58.0 1.0
OG A:SER581 3.7 34.3 1.0
N A:CYS467 3.8 52.0 1.0
C A:GLY466 3.9 51.1 1.0
S3 A:RQM701 3.9 49.9 0.9
FE2 A:RQM701 4.2 38.2 1.0
SG A:CYS546 4.2 45.6 0.3
O A:GLY466 4.3 39.0 1.0
CA A:GLY466 4.3 51.0 1.0
SG A:CYS354 4.5 57.5 1.0
SG A:CYS497 4.6 50.5 1.0
CB A:SER581 4.6 36.9 1.0

Iron binding site 4 out of 14 in 8cmw

Go back to Iron Binding Sites List in 8cmw
Iron binding site 4 out of 14 in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 4 of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe701

b:47.4
occ:1.00
FE4 A:RQM701 0.0 47.4 1.0
SG A:CYS497 2.2 50.5 1.0
S3 A:RQM701 2.3 49.9 0.9
S2 A:RQM701 2.3 54.9 1.0
S1 A:RQM701 2.4 48.9 0.8
FE3 A:RQM701 2.7 40.6 0.8
FE1 A:RQM701 2.7 45.3 0.6
CB A:CYS497 3.5 45.3 1.0
FE2 A:RQM701 3.7 38.2 1.0
S4 A:RQM701 3.8 46.2 0.8
NI A:RQM701 4.0 46.3 0.5
N A:CYS497 4.0 36.0 1.0
CA A:CYS497 4.3 49.6 1.0
CA A:CYS467 4.4 58.0 1.0
CB A:PHE333 4.4 61.1 1.0
O A:GLY466 4.4 39.0 1.0
SG A:CYS546 4.5 45.6 0.3
O A:OH704 4.6 46.5 1.0
SG A:CYS315 4.6 52.5 0.9
SG A:CYS316 4.6 43.2 1.0
CB A:CYS315 4.8 53.2 0.1
CB A:CYS467 4.8 54.7 1.0
C A:GLY466 4.8 51.1 1.0
SG A:CYS467 4.8 35.3 1.0
CB A:CYS315 4.9 52.2 0.9
SG A:CYS354 4.9 57.5 1.0
C A:GLY496 5.0 40.9 1.0
N A:CYS467 5.0 52.0 1.0

Iron binding site 5 out of 14 in 8cmw

Go back to Iron Binding Sites List in 8cmw
Iron binding site 5 out of 14 in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 5 of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe702

b:21.4
occ:1.00
FE1 A:FES702 0.0 21.4 1.0
S1 A:FES702 2.2 27.4 1.0
S2 A:FES702 2.3 31.6 1.0
SG A:CYS59 2.3 38.2 1.0
FE2 A:FES702 2.6 20.3 1.0
CB A:CYS59 3.4 37.9 1.0
O A:HOH833 4.1 40.5 0.5
CB A:PHE61 4.1 40.4 1.0
N A:GLY62 4.3 39.0 1.0
SG A:CYS67 4.6 34.8 1.0
CA A:CYS59 4.8 40.1 1.0
CB A:CYS67 4.9 40.2 1.0
CD2 A:PHE61 4.9 45.9 1.0
CA A:GLY62 4.9 37.5 1.0
CG A:PHE61 5.0 40.5 1.0

Iron binding site 6 out of 14 in 8cmw

Go back to Iron Binding Sites List in 8cmw
Iron binding site 6 out of 14 in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 6 of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe702

b:20.3
occ:1.00
FE2 A:FES702 0.0 20.3 1.0
SG A:CYS67 2.2 34.8 1.0
S1 A:FES702 2.2 27.4 1.0
S2 A:FES702 2.2 31.6 1.0
FE1 A:FES702 2.6 21.4 1.0
CB A:CYS67 3.2 40.2 1.0
CA A:CYS67 4.6 34.7 1.0
SG A:CYS59 4.7 38.2 1.0

Iron binding site 7 out of 14 in 8cmw

Go back to Iron Binding Sites List in 8cmw
Iron binding site 7 out of 14 in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 7 of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe703

b:18.1
occ:1.00
FE1 A:SF4703 0.0 18.1 1.0
SG A:CYS71 2.1 33.5 1.0
S2 A:SF4703 2.2 24.4 1.0
S3 A:SF4703 2.2 30.4 1.0
S4 A:SF4703 2.3 28.4 1.0
FE3 A:SF4703 2.7 20.4 1.0
FE2 A:SF4703 2.7 19.5 1.0
FE4 A:SF4703 2.7 19.0 1.0
CB A:CYS71 3.3 32.8 1.0
N A:CYS71 3.6 32.8 1.0
S1 A:SF4703 3.8 32.4 1.0
CA A:CYS71 3.9 33.5 1.0
CD1 A:ILE220 4.1 45.6 1.0
C A:PHE70 4.2 35.7 1.0
O A:CYS71 4.2 33.1 1.0
C A:CYS71 4.3 34.2 1.0
N A:PHE70 4.6 34.9 1.0
SG A:CYS89 4.6 34.2 1.0
SG A:CYS76 4.6 35.3 1.0
N A:GLY74 4.6 34.7 1.0
CB A:GLN73 4.7 37.1 1.0
SG A:CYS68 4.7 32.9 1.0
O A:PHE70 4.8 33.6 1.0
CG1 A:ILE220 4.8 43.2 1.0
CA A:PHE70 4.9 37.7 1.0
CB A:CYS89 4.9 39.7 1.0
CB A:ILE220 4.9 42.0 1.0
N A:GLN73 5.0 41.0 1.0

Iron binding site 8 out of 14 in 8cmw

Go back to Iron Binding Sites List in 8cmw
Iron binding site 8 out of 14 in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 8 of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe703

b:19.5
occ:1.00
FE2 A:SF4703 0.0 19.5 1.0
SG A:CYS89 2.2 34.2 1.0
S1 A:SF4703 2.2 32.4 1.0
S3 A:SF4703 2.3 30.4 1.0
S4 A:SF4703 2.3 28.4 1.0
FE4 A:SF4703 2.7 19.0 1.0
FE1 A:SF4703 2.7 18.1 1.0
FE3 A:SF4703 2.7 20.4 1.0
CB A:CYS89 3.1 39.7 1.0
N A:CYS89 3.7 45.0 1.0
S2 A:SF4703 3.8 24.4 1.0
CA A:CYS89 4.0 50.8 1.0
CB A:ALA91 4.3 40.0 1.0
CD1 A:ILE220 4.3 45.6 1.0
SG A:CYS71 4.3 33.5 1.0
N A:ILE88 4.5 39.4 1.0
SG A:CYS76 4.6 35.3 1.0
NH1 A:ARG99 4.6 38.3 1.0
CG1 A:ILE220 4.7 43.2 1.0
SG A:CYS68 4.8 32.9 1.0
C A:GLY87 4.8 40.0 1.0
CA A:GLY87 4.8 35.8 1.0
C A:CYS89 4.8 48.3 1.0
C A:ILE88 4.9 41.1 1.0
N A:ALA91 4.9 45.5 1.0

Iron binding site 9 out of 14 in 8cmw

Go back to Iron Binding Sites List in 8cmw
Iron binding site 9 out of 14 in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 9 of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe703

b:20.4
occ:1.00
FE3 A:SF4703 0.0 20.4 1.0
SG A:CYS76 2.1 35.3 1.0
S2 A:SF4703 2.2 24.4 1.0
S4 A:SF4703 2.2 28.4 1.0
S1 A:SF4703 2.3 32.4 1.0
FE1 A:SF4703 2.7 18.1 1.0
FE4 A:SF4703 2.7 19.0 1.0
FE2 A:SF4703 2.7 19.5 1.0
CB A:CYS76 3.0 35.3 1.0
S3 A:SF4703 3.8 30.4 1.0
N A:ILE88 4.1 39.4 1.0
CA A:CYS76 4.2 36.6 1.0
N A:CYS76 4.2 36.2 1.0
CA A:GLY87 4.4 35.8 1.0
SG A:CYS68 4.5 32.9 1.0
CB A:CYS68 4.5 33.5 1.0
SG A:CYS71 4.6 33.5 1.0
CA A:GLY74 4.6 34.9 1.0
O A:CYS68 4.6 33.9 1.0
C A:GLY87 4.7 40.0 1.0
SG A:CYS89 4.7 34.2 1.0
N A:GLY74 4.7 34.7 1.0
N A:CYS89 4.8 45.0 1.0
CB A:ILE88 4.9 40.7 1.0

Iron binding site 10 out of 14 in 8cmw

Go back to Iron Binding Sites List in 8cmw
Iron binding site 10 out of 14 in the A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 10 of A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe703

b:19.0
occ:1.00
FE4 A:SF4703 0.0 19.0 1.0
SG A:CYS68 2.2 32.9 1.0
S2 A:SF4703 2.2 24.4 1.0
S1 A:SF4703 2.2 32.4 1.0
S3 A:SF4703 2.3 30.4 1.0
FE2 A:SF4703 2.7 19.5 1.0
FE3 A:SF4703 2.7 20.4 1.0
FE1 A:SF4703 2.7 18.1 1.0
CB A:CYS68 3.2 33.5 1.0
NH1 A:ARG99 3.7 38.3 1.0
S4 A:SF4703 3.8 28.4 1.0
N A:PHE70 3.9 34.9 1.0
CB A:PHE70 4.3 38.1 1.0
C A:CYS68 4.3 33.8 1.0
CA A:CYS68 4.4 39.0 1.0
CA A:PHE70 4.5 37.7 1.0
O A:CYS68 4.5 33.9 1.0
N A:ARG69 4.5 33.0 1.0
SG A:CYS89 4.6 34.2 1.0
N A:CYS71 4.6 32.8 1.0
CZ A:ARG99 4.7 37.8 1.0
SG A:CYS76 4.7 35.3 1.0
C A:PHE70 4.7 35.7 1.0
CB A:CYS76 4.8 35.3 1.0
SG A:CYS71 4.8 33.5 1.0
C A:ARG69 4.9 32.8 1.0

Reference:

J.Ruickoldt, J.Jeoung, F.Lennartz, H.Dobbek. A225L Variant of the Codh/Acs Complex of C. Hydrogenoformans To Be Published.
Page generated: Fri Aug 9 21:56:26 2024

Last articles

Zn in 9MJ5
Zn in 9HNW
Zn in 9G0L
Zn in 9FNE
Zn in 9DZN
Zn in 9E0I
Zn in 9D32
Zn in 9DAK
Zn in 8ZXC
Zn in 8ZUF
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy