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Iron in PDB 6mq0: B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide

Enzymatic activity of B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide

All present enzymatic activity of B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide:
1.11.1.21;

Protein crystallography data

The structure of B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide, PDB code: 6mq0 was solved by P.C.Loewen, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 35.21 / 1.90
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 100.460, 115.430, 174.600, 90.00, 90.00, 90.00
R / Rfree (%) 14.5 / 17.4

Other elements in 6mq0:

The structure of B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide also contains other interesting chemical elements:

Chlorine (Cl) 1 atom
Sodium (Na) 2 atoms

Iron Binding Sites:

The binding sites of Iron atom in the B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide (pdb code 6mq0). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 2 binding sites of Iron where determined in the B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide, PDB code: 6mq0:
Jump to Iron binding site number: 1; 2;

Iron binding site 1 out of 2 in 6mq0

Go back to Iron Binding Sites List in 6mq0
Iron binding site 1 out of 2 in the B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe801

b:17.9
occ:1.00
FE A:HEM801 0.0 17.9 1.0
ND A:HEM801 1.9 17.3 1.0
NE2 A:HIS279 2.0 19.1 1.0
NA A:HEM801 2.0 19.5 1.0
NC A:HEM801 2.1 16.5 1.0
NB A:HEM801 2.1 19.1 1.0
O A:HOH978 2.6 31.0 1.0
C4D A:HEM801 3.0 16.3 1.0
C1D A:HEM801 3.0 16.0 1.0
CE1 A:HIS279 3.0 18.8 1.0
C1A A:HEM801 3.0 18.1 1.0
CD2 A:HIS279 3.0 18.0 1.0
C4C A:HEM801 3.0 16.4 1.0
C4B A:HEM801 3.0 18.2 1.0
C4A A:HEM801 3.0 19.8 1.0
C1B A:HEM801 3.1 19.9 1.0
C1C A:HEM801 3.1 16.3 1.0
CHA A:HEM801 3.4 18.8 1.0
CHD A:HEM801 3.4 16.1 1.0
CHC A:HEM801 3.4 16.5 1.0
CHB A:HEM801 3.5 19.9 1.0
ND1 A:HIS279 4.1 17.7 1.0
CG A:HIS279 4.2 19.0 1.0
C3D A:HEM801 4.2 16.2 1.0
C3A A:HEM801 4.2 19.6 1.0
C2D A:HEM801 4.2 15.6 1.0
C2A A:HEM801 4.2 19.5 1.0
C3C A:HEM801 4.3 16.4 1.0
C2B A:HEM801 4.3 20.3 1.0
C2C A:HEM801 4.3 16.2 1.0
C3B A:HEM801 4.3 18.9 1.0
NE1 A:TRP111 4.3 17.8 1.0
O A:HOH1512 4.4 32.1 1.0
O1 A:OXY804 4.4 30.9 1.0
CD1 A:TRP111 4.6 17.1 1.0

Iron binding site 2 out of 2 in 6mq0

Go back to Iron Binding Sites List in 6mq0
Iron binding site 2 out of 2 in the B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of B. Pseudomallei Katg Crystallized in the Presence of Furoyl Hydrazide within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Fe801

b:16.9
occ:1.00
FE B:HEM801 0.0 16.9 1.0
ND B:HEM801 1.9 17.1 1.0
NA B:HEM801 2.0 16.1 1.0
NE2 B:HIS279 2.0 17.7 1.0
NC B:HEM801 2.0 15.3 1.0
NB B:HEM801 2.1 16.4 1.0
O B:HOH1153 2.4 24.7 1.0
C4D B:HEM801 2.9 15.6 1.0
C1D B:HEM801 3.0 15.2 1.0
C1A B:HEM801 3.0 16.5 1.0
CE1 B:HIS279 3.0 17.1 1.0
C1B B:HEM801 3.0 17.4 1.0
CD2 B:HIS279 3.0 16.8 1.0
C4A B:HEM801 3.0 16.7 1.0
C4B B:HEM801 3.0 16.3 1.0
C4C B:HEM801 3.1 15.4 1.0
C1C B:HEM801 3.1 15.5 1.0
CHA B:HEM801 3.4 16.0 1.0
CHB B:HEM801 3.4 16.4 1.0
CHC B:HEM801 3.4 15.8 1.0
CHD B:HEM801 3.5 15.1 1.0
ND1 B:HIS279 4.1 17.9 1.0
CG B:HIS279 4.2 16.9 1.0
C3D B:HEM801 4.2 15.6 1.0
C2D B:HEM801 4.2 15.3 1.0
C2A B:HEM801 4.2 16.3 1.0
C3A B:HEM801 4.2 16.7 1.0
C2B B:HEM801 4.3 16.4 1.0
C3C B:HEM801 4.3 14.7 1.0
C2C B:HEM801 4.3 15.6 1.0
O B:HOH1515 4.3 31.7 1.0
C3B B:HEM801 4.3 17.1 1.0
NE1 B:TRP111 4.3 14.2 1.0
O1 B:OXY803 4.5 26.4 1.0
CD1 B:TRP111 4.5 14.3 1.0

Reference:

P.C.Loewen, P.C.Loewen. N/A N/A.
Page generated: Sun Dec 13 16:44:15 2020

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