Iron in PDB 3bvf: Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin

All present enzymatic activity of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin:
1.16.3.1;

The structure of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin, PDB code: 3bvf was solved by K.H.Kim, K.J.Cho, J.H.Lee, H.J.Shin, I.S.Yang, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	24.46 / 1.50
Space group	I 4
Cell size a, b, c (Å), α, β, γ (°)	128.658, 128.658, 165.454, 90.00, 90.00, 90.00
R / Rfree (%)	16.8 / 18.3

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 15;

Binding sites:

The binding sites of Iron atom in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin (pdb code 3bvf). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 15 binding sites of Iron where determined in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin, PDB code: 3bvf:
Jump to Iron binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Iron binding site 1 out of 15 in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe1006 b:26.2 occ:0.50 FE A:FE1007 2.5 16.8 0.5 OE1 A:GLN127 2.7 12.7 1.0 OE2 A:GLU17 2.7 14.6 1.0 ND1 A:HIS53 3.3 13.5 1.0 OE1 A:GLU50 3.3 13.9 1.0 OE1 A:GLU130 3.4 13.1 1.0 O A:HOH1033 3.5 16.9 1.0 CD A:GLU17 3.5 13.6 1.0 OE1 A:GLU17 3.6 14.9 1.0 CG2 A:ILE97 3.7 12.4 1.0 CD A:GLU50 3.7 13.6 1.0 OE2 A:GLU50 3.7 14.1 1.0 CE1 A:HIS53 3.7 13.1 1.0 CD A:GLN127 3.8 11.7 1.0 CE1 A:TYR123 4.0 12.0 1.0 CD A:GLU130 4.4 13.2 1.0 CG A:HIS53 4.4 12.2 1.0 OH A:TYR123 4.4 12.6 1.0 OE2 A:GLU94 4.6 13.7 1.0 CG A:GLN127 4.6 11.1 1.0 NE2 A:GLN127 4.6 12.0 1.0 CB A:GLN127 4.6 10.9 1.0 CZ A:TYR123 4.7 11.9 1.0 OE2 A:GLU130 4.7 14.8 1.0 CB A:ILE97 4.8 12.4 1.0 CB A:HIS53 4.9 11.0 1.0 CG A:GLU50 5.0 12.1 1.0 CA A:GLN127 5.0 10.8 1.0 CG A:GLU17 5.0 12.4 1.0 CD1 A:TYR123 5.0 12.4 1.0 NE2 A:HIS53 5.0 14.8 1.0

Iron binding site 2 out of 15 in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe1007 b:16.8 occ:0.50 OE1 A:GLN127 2.3 12.7 1.0 OE1 A:GLU130 2.3 13.1 1.0 OE2 A:GLU94 2.3 13.7 1.0 OE1 A:GLU50 2.4 13.9 1.0 FE A:FE1006 2.5 26.2 0.5 CD A:GLU94 3.2 12.9 1.0 CD A:GLN127 3.2 11.7 1.0 OE1 A:GLU94 3.3 13.0 1.0 CD A:GLU50 3.3 13.6 1.0 CD A:GLU130 3.5 13.2 1.0 NE2 A:GLN127 3.5 12.0 1.0 OE2 A:GLU50 3.6 14.1 1.0 O A:HOH1033 3.7 16.9 1.0 CB A:GLU130 3.9 11.5 1.0 CE1 A:HIS46 4.0 11.6 1.0 NE2 A:HIS46 4.1 11.8 1.0 CG A:GLU130 4.3 12.0 1.0 CG2 A:ILE97 4.3 12.4 1.0 OE2 A:GLU130 4.4 14.8 1.0 CG A:GLU94 4.6 12.1 1.0 CG A:GLN127 4.6 11.1 1.0 CG A:GLU50 4.7 12.1 1.0 CB A:ILE97 4.8 12.4 1.0 CE1 A:HIS53 4.9 13.1 1.0 CA A:GLN127 4.9 10.8 1.0 ND1 A:HIS53 5.0 13.5 1.0 OE2 A:GLU17 5.0 14.6 1.0

Iron binding site 3 out of 15 in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 3 of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe1008 b:70.0 occ:0.60 ND1 A:HIS149 4.3 22.0 1.0 ND1 B:HIS149 4.5 22.9 1.0 ND1 D:HIS149 4.5 23.1 1.0 CD1 A:LEU153 4.7 16.2 1.0 CD1 B:LEU153 4.7 16.4 1.0 CD1 D:LEU153 4.7 16.6 1.0 O A:ASN148 4.8 26.1 1.0 ND2 B:ASN148 4.9 27.4 0.5

Iron binding site 4 out of 15 in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 4 of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe1006 b:28.1 occ:0.50 FE B:FE1007 2.4 18.1 0.5 OE2 B:GLU17 2.7 14.3 1.0 OE1 B:GLN127 2.8 12.7 1.0 OE1 B:GLU50 3.1 14.9 1.0 ND1 B:HIS53 3.3 15.0 1.0 OE1 B:GLU130 3.5 13.7 1.0 CD B:GLU17 3.5 13.7 1.0 O B:HOH1027 3.5 16.6 1.0 OE1 B:GLU17 3.5 15.4 1.0 CD B:GLU50 3.6 14.0 1.0 OE2 B:GLU50 3.6 14.4 1.0 CG2 B:ILE97 3.7 13.4 1.0 CD B:GLN127 3.8 12.6 1.0 CE1 B:HIS53 3.9 14.7 1.0 CE1 B:TYR123 4.1 13.0 1.0 CD B:GLU130 4.5 13.6 1.0 OH B:TYR123 4.5 13.3 1.0 CG B:HIS53 4.5 13.5 1.0 OE2 B:GLU94 4.5 13.8 1.0 NE2 B:GLN127 4.7 12.8 1.0 CG B:GLN127 4.7 13.0 1.0 CZ B:TYR123 4.7 13.1 1.0 CB B:GLN127 4.7 12.7 1.0 CB B:ILE97 4.8 13.5 1.0 OE2 B:GLU130 4.8 15.3 1.0 CG B:GLU50 4.8 12.6 1.0 CG B:GLU17 4.9 12.0 1.0 CB B:HIS53 5.0 12.3 1.0

Iron binding site 5 out of 15 in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 5 of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe1007 b:18.1 occ:0.50 OE1 B:GLN127 2.3 12.7 1.0 OE1 B:GLU50 2.3 14.9 1.0 OE2 B:GLU94 2.4 13.8 1.0 OE1 B:GLU130 2.4 13.7 1.0 FE B:FE1006 2.4 28.1 0.5 CD B:GLU94 3.2 13.6 1.0 CD B:GLN127 3.3 12.6 1.0 CD B:GLU50 3.3 14.0 1.0 OE1 B:GLU94 3.3 13.9 1.0 OE2 B:GLU50 3.5 14.4 1.0 CD B:GLU130 3.6 13.6 1.0 NE2 B:GLN127 3.6 12.8 1.0 O B:HOH1027 3.7 16.6 1.0 CB B:GLU130 4.0 12.8 1.0 CE1 B:HIS46 4.0 12.0 1.0 NE2 B:HIS46 4.1 12.3 1.0 CG2 B:ILE97 4.3 13.4 1.0 CG B:GLU130 4.4 13.1 1.0 OE2 B:GLU130 4.5 15.3 1.0 CG B:GLU94 4.6 12.9 1.0 CG B:GLN127 4.7 13.0 1.0 CG B:GLU50 4.7 12.6 1.0 CB B:ILE97 4.8 13.5 1.0 OE2 B:GLU17 4.9 14.3 1.0 ND1 B:HIS53 5.0 15.0 1.0 CE1 B:HIS53 5.0 14.7 1.0 CA B:GLN127 5.0 12.7 1.0

Iron binding site 6 out of 15 in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 6 of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ C:Fe1006 b:26.0 occ:0.50 FE C:FE1007 2.5 17.4 0.5 OE2 C:GLU17 2.7 15.2 1.0 OE1 C:GLN127 2.8 12.3 1.0 OE1 C:GLU50 3.2 14.7 1.0 ND1 C:HIS53 3.2 13.8 1.0 O C:HOH1047 3.4 18.7 1.0 OE1 C:GLU130 3.4 12.7 1.0 CD C:GLU17 3.5 13.9 1.0 OE1 C:GLU17 3.5 15.5 1.0 OE2 C:GLU50 3.6 14.6 1.0 CD C:GLU50 3.7 14.2 1.0 CE1 C:HIS53 3.7 13.2 1.0 CG2 C:ILE97 3.7 13.1 1.0 CD C:GLN127 3.8 11.8 1.0 CE1 C:TYR123 4.1 11.7 1.0 CD C:GLU130 4.4 12.9 1.0 CG C:HIS53 4.4 12.5 1.0 OH C:TYR123 4.5 13.3 1.0 OE2 C:GLU94 4.5 14.2 1.0 CG C:GLN127 4.7 11.6 1.0 OE2 C:GLU130 4.7 14.3 1.0 NE2 C:GLN127 4.7 12.0 1.0 CZ C:TYR123 4.7 12.3 1.0 CB C:GLN127 4.7 11.8 1.0 CB C:ILE97 4.9 13.3 1.0 CG C:GLU50 4.9 13.1 1.0 CB C:HIS53 4.9 11.8 1.0 CG C:GLU17 4.9 12.4 1.0 NE2 C:HIS53 5.0 14.8 1.0

Iron binding site 7 out of 15 in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 7 of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ C:Fe1007 b:17.4 occ:0.50 OE2 C:GLU94 2.3 14.2 1.0 OE1 C:GLN127 2.3 12.3 1.0 OE1 C:GLU130 2.3 12.7 1.0 OE1 C:GLU50 2.4 14.7 1.0 FE C:FE1006 2.5 26.0 0.5 CD C:GLU94 3.1 13.8 1.0 CD C:GLN127 3.3 11.8 1.0 OE1 C:GLU94 3.3 13.9 1.0 CD C:GLU50 3.3 14.2 1.0 CD C:GLU130 3.5 12.9 1.0 OE2 C:GLU50 3.5 14.6 1.0 NE2 C:GLN127 3.6 12.0 1.0 O C:HOH1047 3.6 18.7 1.0 CB C:GLU130 3.9 12.4 1.0 CE1 C:HIS46 4.0 12.1 1.0 NE2 C:HIS46 4.1 11.8 1.0 CG C:GLU130 4.3 12.8 1.0 CG2 C:ILE97 4.4 13.1 1.0 OE2 C:GLU130 4.4 14.3 1.0 CG C:GLU94 4.6 13.2 1.0 CG C:GLN127 4.7 11.6 1.0 CG C:GLU50 4.7 13.1 1.0 CB C:ILE97 4.8 13.3 1.0 CE1 C:HIS53 4.9 13.2 1.0 ND1 C:HIS53 4.9 13.8 1.0 OE2 C:GLU17 4.9 15.2 1.0 CA C:GLN127 5.0 11.7 1.0

Iron binding site 8 out of 15 in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 8 of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ D:Fe1006 b:26.1 occ:0.50 FE D:FE1007 2.5 18.5 0.5 OE2 D:GLU17 2.7 15.2 1.0 OE1 D:GLN127 2.7 13.3 1.0 ND1 D:HIS53 3.2 14.5 1.0 OE1 D:GLU50 3.2 15.3 1.0 O D:HOH1058 3.3 19.4 1.0 OE1 D:GLU130 3.4 14.2 1.0 CD D:GLU17 3.5 15.3 1.0 OE1 D:GLU17 3.5 16.7 1.0 OE2 D:GLU50 3.6 15.1 1.0 CD D:GLU50 3.6 14.2 1.0 CE1 D:HIS53 3.6 14.6 1.0 CG2 D:ILE97 3.8 13.6 1.0 CD D:GLN127 3.8 12.3 1.0 CE1 D:TYR123 4.1 13.5 1.0 CD D:GLU130 4.3 13.9 1.0 CG D:HIS53 4.4 13.4 1.0 OH D:TYR123 4.5 14.2 1.0 OE2 D:GLU94 4.6 14.2 1.0 OE2 D:GLU130 4.7 15.8 1.0 CB D:GLN127 4.7 12.4 1.0 CG D:GLN127 4.7 12.6 1.0 NE2 D:GLN127 4.7 12.4 1.0 CZ D:TYR123 4.8 13.4 1.0 CG D:GLU50 4.9 13.0 1.0 NE2 D:HIS53 4.9 15.9 1.0 CB D:HIS53 4.9 12.5 1.0 CB D:ILE97 4.9 13.5 1.0 CG D:GLU17 4.9 14.3 1.0

Iron binding site 9 out of 15 in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 9 of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ D:Fe1007 b:18.5 occ:0.50 OE1 D:GLN127 2.2 13.3 1.0 OE1 D:GLU130 2.3 14.2 1.0 OE2 D:GLU94 2.4 14.2 1.0 OE1 D:GLU50 2.4 15.3 1.0 FE D:FE1006 2.5 26.1 0.5 CD D:GLU94 3.2 14.2 1.0 CD D:GLN127 3.2 12.3 1.0 CD D:GLU50 3.3 14.2 1.0 OE1 D:GLU94 3.4 14.1 1.0 CD D:GLU130 3.5 13.9 1.0 OE2 D:GLU50 3.5 15.1 1.0 NE2 D:GLN127 3.6 12.4 1.0 O D:HOH1058 3.6 19.4 1.0 CB D:GLU130 3.9 13.2 1.0 CE1 D:HIS46 4.0 12.8 1.0 NE2 D:HIS46 4.1 12.7 1.0 CG D:GLU130 4.3 14.1 1.0 OE2 D:GLU130 4.4 15.8 1.0 CG2 D:ILE97 4.4 13.6 1.0 CG D:GLN127 4.6 12.6 1.0 CG D:GLU94 4.6 13.7 1.0 CG D:GLU50 4.7 13.0 1.0 CE1 D:HIS53 4.8 14.6 1.0 CB D:ILE97 4.9 13.5 1.0 CA D:GLN127 4.9 12.4 1.0 ND1 D:HIS53 4.9 14.5 1.0 OE2 D:GLU17 5.0 15.2 1.0

Iron binding site 10 out of 15 in the Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 10 of Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ E:Fe1006 b:24.8 occ:0.50 FE E:FE1007 2.4 17.1 0.5 OE2 E:GLU17 2.7 13.6 1.0 OE1 E:GLN127 2.8 11.7 1.0 ND1 E:HIS53 3.2 14.1 1.0 OE1 E:GLU50 3.2 14.0 1.0 O E:HOH1040 3.3 16.6 1.0 OE1 E:GLU130 3.4 13.6 1.0 OE1 E:GLU17 3.4 13.3 1.0 CD E:GLU17 3.4 12.2 1.0 OE2 E:GLU50 3.6 13.9 1.0 CD E:GLU50 3.7 13.1 1.0 CE1 E:HIS53 3.7 14.1 1.0 CG2 E:ILE97 3.7 12.5 1.0 CD E:GLN127 3.8 11.6 1.0 CE1 E:TYR123 4.1 11.6 1.0 CD E:GLU130 4.3 12.8 1.0 CG E:HIS53 4.4 12.6 1.0 OH E:TYR123 4.5 12.2 1.0 OE2 E:GLU94 4.6 12.6 1.0 CG E:GLN127 4.7 12.0 1.0 OE2 E:GLU130 4.7 14.2 1.0 CB E:GLN127 4.7 12.0 1.0 NE2 E:GLN127 4.7 11.3 1.0 CZ E:TYR123 4.8 11.4 1.0 CB E:ILE97 4.9 12.1 1.0 CG E:GLU17 4.9 10.8 1.0 CG E:GLU50 4.9 11.4 1.0 NE2 E:HIS53 4.9 15.2 1.0 CB E:HIS53 5.0 10.9 1.0

K.H.Kim, K.J.Cho, J.H.Lee, H.J.Shin, I.S.Yang. Structural Basis For the Iron Uptake Mechanism of Helicobacter Pylori Ferritin To Be Published.