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Iron in PDB 4qjq: Crystal Structure of Goat Lactoperoxidase in Complex with Octopamine at 2.1 Angstrom Resolution

Enzymatic activity of Crystal Structure of Goat Lactoperoxidase in Complex with Octopamine at 2.1 Angstrom Resolution

All present enzymatic activity of Crystal Structure of Goat Lactoperoxidase in Complex with Octopamine at 2.1 Angstrom Resolution:
1.11.1.7;

Protein crystallography data

The structure of Crystal Structure of Goat Lactoperoxidase in Complex with Octopamine at 2.1 Angstrom Resolution, PDB code: 4qjq was solved by R.P.Singh, G.S.Kushwaha, A.K.Singh, M.Sinha, P.Kaur, S.Sharma, T.P.Singh, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 73.51 / 2.10
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 53.947, 80.356, 75.391, 90.00, 102.81, 90.00
R / Rfree (%) 20.4 / 27.8

Other elements in 4qjq:

The structure of Crystal Structure of Goat Lactoperoxidase in Complex with Octopamine at 2.1 Angstrom Resolution also contains other interesting chemical elements:

Iodine (I) 13 atoms
Calcium (Ca) 1 atom

Iron Binding Sites:

The binding sites of Iron atom in the Crystal Structure of Goat Lactoperoxidase in Complex with Octopamine at 2.1 Angstrom Resolution (pdb code 4qjq). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total only one binding site of Iron was determined in the Crystal Structure of Goat Lactoperoxidase in Complex with Octopamine at 2.1 Angstrom Resolution, PDB code: 4qjq:

Iron binding site 1 out of 1 in 4qjq

Go back to Iron Binding Sites List in 4qjq
Iron binding site 1 out of 1 in the Crystal Structure of Goat Lactoperoxidase in Complex with Octopamine at 2.1 Angstrom Resolution


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Crystal Structure of Goat Lactoperoxidase in Complex with Octopamine at 2.1 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe601

b:41.8
occ:1.00
 FE A:HEM601 0.0 41.8 1.0
ND A:HEM601 1.9 36.5 1.0
NA A:HEM601 2.0 38.7 1.0
O A:HOH718 2.0 52.2 1.0
NC A:HEM601 2.1 34.4 1.0
NB A:HEM601 2.1 37.6 1.0
NE2 A:HIS351 2.8 39.5 1.0
C4D A:HEM601 2.9 34.6 1.0
C1D A:HEM601 2.9 36.2 1.0
C1A A:HEM601 2.9 36.9 1.0
C4C A:HEM601 3.0 31.9 1.0
C4A A:HEM601 3.0 41.1 1.0
C1B A:HEM601 3.1 36.0 1.0
C4B A:HEM601 3.1 35.1 1.0
C1C A:HEM601 3.1 35.9 1.0
CHA A:HEM601 3.3 39.8 1.0
CHD A:HEM601 3.4 36.9 1.0
CHB A:HEM601 3.5 42.0 1.0
CHC A:HEM601 3.5 34.0 1.0
CD2 A:HIS351 3.5 40.0 1.0
CE1 A:HIS351 3.9 39.8 1.0
O A:HOH937 3.9 72.2 1.0
O4 A:OTR614 4.0 42.8 1.0
C3D A:HEM601 4.1 36.9 1.0
C2D A:HEM601 4.1 36.5 1.0
C2A A:HEM601 4.1 42.5 1.0
C3A A:HEM601 4.2 43.9 1.0
C3C A:HEM601 4.2 35.5 1.0
C2C A:HEM601 4.3 38.6 1.0
C2B A:HEM601 4.3 37.0 1.0
C3B A:HEM601 4.3 33.4 1.0
NE2 A:GLN105 4.4 40.6 1.0
CG A:GLN105 4.7 39.9 1.0
NE2 A:HIS109 4.7 50.3 1.0
CG A:HIS351 4.8 40.9 1.0
ND1 A:HIS351 4.9 40.9 1.0
CD A:GLN105 4.9 43.0 1.0

Reference:

R.P.Singh, G.S.Kushwaha, A.K.Singh, M.Sinha, P.Kaur, S.Sharma, T.P.Singh. Crystal Structure of Goat Lactoperoxidase in Complex with Octopamine at 2.1 Angstrom Resolution To Be Published.
Page generated: Mon Aug 5 08:47:53 2024

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