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Calcium in PDB 1gwt: Recombinant Horseradish Peroxidase C1A PHE221MET

Enzymatic activity of Recombinant Horseradish Peroxidase C1A PHE221MET

All present enzymatic activity of Recombinant Horseradish Peroxidase C1A PHE221MET:
1.11.1.7;

Protein crystallography data

The structure of Recombinant Horseradish Peroxidase C1A PHE221MET, PDB code: 1gwt was solved by A.Henriksen, N.Brissett, M.Gajhede, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 12.95 / 1.70
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 40.283, 67.185, 117.461, 90.00, 90.00, 90.00
R / Rfree (%) 17.2 / 19.8

Other elements in 1gwt:

The structure of Recombinant Horseradish Peroxidase C1A PHE221MET also contains other interesting chemical elements:

Iron (Fe) 1 atom
Sodium (Na) 1 atom

Calcium Binding Sites:

The binding sites of Calcium atom in the Recombinant Horseradish Peroxidase C1A PHE221MET (pdb code 1gwt). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 2 binding sites of Calcium where determined in the Recombinant Horseradish Peroxidase C1A PHE221MET, PDB code: 1gwt:
Jump to Calcium binding site number: 1; 2;

Calcium binding site 1 out of 2 in 1gwt

Go back to Calcium Binding Sites List in 1gwt
Calcium binding site 1 out of 2 in the Recombinant Horseradish Peroxidase C1A PHE221MET


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of Recombinant Horseradish Peroxidase C1A PHE221MET within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca501

b:6.5
occ:1.00
O A:VAL46 2.3 6.9 1.0
O A:ASP43 2.3 7.3 1.0
OD1 A:ASP43 2.3 7.7 1.0
OD1 A:ASP50 2.4 6.7 1.0
O A:GLY48 2.5 6.2 1.0
O A:HOH2112 2.5 8.2 1.0
OG A:SER52 2.6 8.0 1.0
C A:ASP43 3.2 6.6 1.0
CG A:ASP50 3.4 6.9 1.0
CG A:ASP43 3.5 9.8 1.0
C A:VAL46 3.5 7.3 1.0
CA A:ASP43 3.7 7.4 1.0
CB A:SER52 3.7 7.3 1.0
C A:GLY48 3.7 6.8 1.0
N A:SER52 3.9 8.9 1.0
OD2 A:ASP50 3.9 7.4 1.0
N A:ASP50 4.0 6.8 1.0
CB A:VAL46 4.2 7.5 1.0
CB A:ASP43 4.2 7.0 1.0
CA A:VAL46 4.2 7.0 1.0
N A:GLY48 4.3 7.0 1.0
CA A:SER52 4.3 8.1 1.0
N A:CYS44 4.3 7.1 1.0
N A:VAL46 4.4 6.1 1.0
OD2 A:ASP43 4.4 8.4 1.0
C A:ASN47 4.4 9.3 1.0
N A:ILE53 4.5 7.7 1.0
N A:ASN47 4.5 6.6 1.0
N A:ALA51 4.6 7.7 1.0
CA A:GLY48 4.6 6.7 1.0
CB A:ASP50 4.6 8.2 1.0
OE1 A:GLU64 4.6 6.4 1.0
N A:CYS49 4.6 6.2 1.0
CA A:CYS49 4.6 7.5 1.0
CB A:ASN47 4.7 10.2 1.0
CA A:ASP50 4.7 7.4 1.0
OE2 A:GLU64 4.7 6.7 1.0
CA A:ASN47 4.7 8.1 1.0
O A:HIS42 4.7 6.9 1.0
O A:ASN47 4.8 8.8 1.0
C A:ASP50 4.8 7.7 1.0
CA A:CYS44 4.8 6.4 1.0
C A:CYS49 4.8 7.9 1.0
CG1 A:VAL46 4.9 7.3 1.0
C A:SER52 4.9 7.9 1.0
C A:ALA51 5.0 9.2 1.0

Calcium binding site 2 out of 2 in 1gwt

Go back to Calcium Binding Sites List in 1gwt
Calcium binding site 2 out of 2 in the Recombinant Horseradish Peroxidase C1A PHE221MET


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of Recombinant Horseradish Peroxidase C1A PHE221MET within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca502

b:11.4
occ:1.00
O A:THR171 2.3 9.6 1.0
OD1 A:ASP222 2.3 11.7 1.0
O A:ILE228 2.4 12.8 1.0
OG1 A:THR225 2.4 10.2 1.0
O A:THR225 2.4 13.1 1.0
OG1 A:THR171 2.5 9.6 1.0
OD2 A:ASP230 2.5 11.1 1.0
C A:THR171 3.3 10.4 1.0
C A:THR225 3.4 12.8 1.0
CG A:ASP222 3.4 9.4 1.0
CG A:ASP230 3.5 12.7 1.0
CB A:THR225 3.5 12.2 1.0
C A:ILE228 3.5 13.1 1.0
CB A:THR171 3.6 10.2 1.0
OD1 A:ASP230 3.8 12.5 1.0
CA A:THR171 3.8 10.4 1.0
CA A:THR225 3.9 12.3 1.0
CB A:ASP222 3.9 10.1 1.0
N A:ASP230 4.1 11.2 1.0
N A:THR225 4.2 12.3 1.0
N A:ILE228 4.3 12.0 1.0
CG2 A:THR171 4.3 10.3 1.0
CA A:ILE228 4.3 12.4 1.0
CB A:LYS232 4.4 13.0 1.0
OD2 A:ASP222 4.4 9.3 1.0
CB A:ILE228 4.5 14.2 1.0
N A:PHE172 4.5 10.8 1.0
N A:PRO226 4.6 12.6 1.0
O A:ASP230 4.6 9.5 1.0
N A:PHE229 4.6 11.4 1.0
CG A:LYS232 4.6 16.9 1.0
CB A:ASP230 4.7 12.3 1.0
CA A:PHE229 4.7 12.7 1.0
CG2 A:THR225 4.8 13.5 1.0
CA A:ASP230 4.8 11.2 1.0
C A:PHE229 4.9 12.2 1.0
CA A:PHE172 4.9 11.1 1.0
C A:ASP230 4.9 11.7 1.0

Reference:

A.Henriksen, N.Brissett, K.Meno, O.Mirza, M.Gajhede. Hrpc Heme Crevice Architecture To Be Published.
Page generated: Thu Jul 11 08:52:56 2024

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