Iron in PDB 8fvv: Rubrerythrin From B. Pseudomallei: Iron-Bound

The structure of Rubrerythrin From B. Pseudomallei: Iron-Bound, PDB code: 8fvv was solved by D.C.F.Monteiro, M.E.Snell, G.R.Budziszewski, S.E.J.Bowman, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.90 / 1.93
Space group	H 3
Cell size a, b, c (Å), α, β, γ (°)	202.17, 202.17, 69.825, 90, 90, 120
R / Rfree (%)	16.1 / 20.9

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 12;

Binding sites:

The binding sites of Iron atom in the Rubrerythrin From B. Pseudomallei: Iron-Bound (pdb code 8fvv). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 12 binding sites of Iron where determined in the Rubrerythrin From B. Pseudomallei: Iron-Bound, PDB code: 8fvv:
Jump to Iron binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Iron binding site 1 out of 12 in the Rubrerythrin From B. Pseudomallei: Iron-Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Rubrerythrin From B. Pseudomallei: Iron-Bound within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe201 b:21.2 occ:0.62 HD1 A:HIS127 1.3 17.9 0.0 OE1 A:GLU124 1.9 26.6 1.0 OE2 A:GLU90 2.0 26.4 1.0 OE2 B:GLU53 2.1 22.5 1.0 ND1 A:HIS127 2.2 17.2 1.0 O A:HOH325 2.4 21.1 0.5 CD A:GLU90 2.6 29.1 1.0 OE1 A:GLU90 2.6 37.1 1.0 CD A:GLU124 2.8 25.1 1.0 CD B:GLU53 3.0 19.7 1.0 CE1 A:HIS127 3.1 17.3 1.0 OE2 A:GLU124 3.1 35.4 1.0 OE1 B:GLU53 3.2 21.7 1.0 HE1 A:HIS127 3.2 17.1 1.0 CG A:HIS127 3.2 17.5 1.0 HB2 A:HIS127 3.4 17.4 1.0 HB3 A:HIS127 3.4 17.4 1.0 O A:HOH325 3.4 14.0 0.5 HE2 B:TYR27 3.4 17.6 1.0 CB A:HIS127 3.6 17.5 1.0 HA A:GLU124 3.6 18.1 1.0 FE B:FE202 3.8 59.5 0.5 HG23 B:THR49 3.9 16.7 1.0 OH B:TYR27 4.1 18.2 1.0 CG A:GLU90 4.1 28.1 1.0 HG22 B:THR49 4.2 16.7 1.0 CG A:GLU124 4.2 22.6 1.0 NE2 A:HIS127 4.3 16.4 1.0 HG21 B:THR49 4.3 16.7 1.0 CE2 B:TYR27 4.3 17.5 1.0 CG2 B:THR49 4.3 16.4 1.0 CD2 A:HIS127 4.3 16.4 1.0 HG3 A:GLU90 4.3 27.3 1.0 CG B:GLU53 4.4 18.1 1.0 CA A:GLU124 4.5 18.2 1.0 HB3 A:GLU124 4.5 20.1 1.0 HG2 A:GLU90 4.5 27.2 1.0 HG3 B:GLU53 4.6 18.0 1.0 HG2 B:GLU53 4.6 18.0 1.0 HD1 B:HIS56 4.6 17.6 0.0 CB A:GLU124 4.6 20.1 1.0 HG3 A:GLU124 4.6 22.6 1.0 HE1 B:HIS56 4.7 17.0 1.0 HE2 A:TYR131 4.7 18.8 1.0 CZ B:TYR27 4.7 17.8 1.0 HH B:TYR27 4.7 18.2 0.0 OE1 A:GLU93 4.7 33.4 1.0 HG2 A:GLU124 4.8 22.6 1.0 HB3 A:GLU90 4.9 24.0 1.0 OE2 A:GLU93 5.0 39.5 1.0 HA A:GLU90 5.0 20.9 1.0

Iron binding site 2 out of 12 in the Rubrerythrin From B. Pseudomallei: Iron-Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of Rubrerythrin From B. Pseudomallei: Iron-Bound within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe202 b:30.1 occ:0.22 HD1 A:HIS56 1.5 19.6 0.0 OE2 B:GLU124 1.9 33.1 1.0 OE1 A:GLU53 1.9 21.4 1.0 OE2 A:GLU20 1.9 39.7 1.0 ND1 A:HIS56 2.4 20.0 1.0 CD A:GLU20 2.4 32.6 1.0 OE1 A:GLU20 2.6 44.7 1.0 CD A:GLU53 3.1 20.1 1.0 CD B:GLU124 3.1 27.3 1.0 HB2 A:HIS56 3.1 18.5 1.0 HA A:GLU53 3.2 16.7 1.0 CG A:HIS56 3.3 18.8 1.0 CE1 A:HIS56 3.4 22.2 1.0 CB A:HIS56 3.5 18.7 1.0 O B:HOH336 3.5 24.4 1.0 HB3 A:HIS56 3.5 18.5 1.0 HE1 A:HIS56 3.6 21.5 1.0 OE2 A:GLU53 3.6 22.3 1.0 CG A:GLU20 3.7 28.1 1.0 FE B:FE201 3.8 34.8 1.0 OE1 B:GLU124 3.8 29.4 1.0 HG3 A:GLU20 3.8 28.2 1.0 HE2 B:TYR98 4.0 24.8 1.0 HE1 B:HIS127 4.0 20.0 1.0 CA A:GLU53 4.1 16.3 1.0 HB3 A:GLU20 4.1 24.2 1.0 CG B:GLU124 4.2 24.7 1.0 HG2 B:GLU124 4.2 24.5 1.0 HD1 B:HIS127 4.2 20.5 0.0 HB3 A:GLU53 4.3 17.9 1.0 CG A:GLU53 4.3 19.4 1.0 HG3 B:GLU124 4.3 24.6 1.0 HD12 B:LEU120 4.3 23.4 1.0 HG2 A:GLU20 4.4 28.0 1.0 CB A:GLU53 4.4 17.9 1.0 OE1 B:GLU93 4.4 39.0 1.0 CD2 A:HIS56 4.4 19.4 1.0 CB A:GLU20 4.5 24.4 1.0 NE2 A:HIS56 4.5 21.6 1.0 OH B:TYR98 4.5 25.8 1.0 HA A:GLU20 4.5 20.8 1.0 CE1 B:HIS127 4.7 20.6 1.0 N A:GLU53 4.7 16.6 1.0 ND1 B:HIS127 4.7 19.9 1.0 HB3 B:LEU120 4.8 24.2 1.0 HG3 A:GLU53 4.8 19.2 1.0 CE2 B:TYR98 4.8 23.9 1.0 O A:GLY52 4.9 19.1 1.0 HG2 A:GLU53 4.9 19.1 1.0

Iron binding site 3 out of 12 in the Rubrerythrin From B. Pseudomallei: Iron-Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 3 of Rubrerythrin From B. Pseudomallei: Iron-Bound within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe201 b:34.8 occ:1.00 HD1 B:HIS127 1.4 20.5 0.0 OE1 B:GLU124 1.9 29.4 1.0 OE2 A:GLU53 2.0 22.3 1.0 OE2 B:GLU90 2.2 36.4 1.0 ND1 B:HIS127 2.3 19.9 1.0 OE1 B:GLU90 2.5 48.3 1.0 CD B:GLU90 2.6 38.0 1.0 CD B:GLU124 2.8 27.3 1.0 O B:HOH336 2.8 24.4 1.0 OE2 B:GLU124 2.9 33.1 1.0 CD A:GLU53 2.9 20.1 1.0 OE1 A:GLU53 3.2 21.4 1.0 CE1 B:HIS127 3.2 20.6 1.0 CG B:HIS127 3.3 19.1 1.0 HE1 B:HIS127 3.4 20.0 1.0 HB2 B:HIS127 3.4 19.2 1.0 HB3 B:HIS127 3.4 19.2 1.0 HE2 A:TYR27 3.5 15.4 1.0 CB B:HIS127 3.6 19.4 1.0 HA B:GLU124 3.7 20.8 1.0 HG23 A:THR49 3.8 16.6 1.0 FE A:FE202 3.8 30.1 0.2 OH A:TYR27 4.1 16.5 1.0 HG22 A:THR49 4.1 16.6 1.0 CG B:GLU90 4.2 31.9 1.0 CG B:GLU124 4.2 24.7 1.0 HG21 A:THR49 4.2 16.6 1.0 CG2 A:THR49 4.2 16.7 1.0 CG A:GLU53 4.3 19.4 1.0 CE2 A:TYR27 4.4 15.3 1.0 NE2 B:HIS127 4.4 18.8 1.0 CD2 B:HIS127 4.4 18.8 1.0 HD1 A:HIS56 4.5 19.6 0.0 HG3 B:GLU90 4.5 31.7 1.0 HG2 A:GLU53 4.5 19.1 1.0 HG3 A:GLU53 4.5 19.2 1.0 HG2 B:GLU90 4.6 31.4 1.0 HB3 B:GLU124 4.6 22.1 1.0 CA B:GLU124 4.6 20.6 1.0 HE2 B:TYR131 4.6 20.0 1.0 HG3 B:GLU124 4.6 24.6 1.0 OE1 B:GLU93 4.6 39.0 1.0 HH A:TYR27 4.7 16.7 0.0 CB B:GLU124 4.7 21.7 1.0 CZ A:TYR27 4.7 15.3 1.0 HG2 B:GLU124 4.8 24.5 1.0 HB3 B:GLU90 4.8 26.6 1.0 O A:HOH397 4.8 10.9 0.1 OE1 A:GLU20 4.9 44.7 1.0 HE1 A:HIS56 4.9 21.5 1.0 HB1 A:ALA23 4.9 15.4 1.0

Iron binding site 4 out of 12 in the Rubrerythrin From B. Pseudomallei: Iron-Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 4 of Rubrerythrin From B. Pseudomallei: Iron-Bound within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe202 b:59.5 occ:0.45 HD1 B:HIS56 1.6 17.6 0.0 OE2 B:GLU20 1.9 37.7 1.0 OE2 A:GLU124 1.9 35.4 1.0 OE1 B:GLU53 2.1 21.7 1.0 ND1 B:HIS56 2.4 17.0 1.0 OE1 B:GLU20 2.5 33.9 1.0 CD B:GLU20 2.5 33.2 1.0 O A:HOH325 2.6 14.0 0.5 CD A:GLU124 3.0 25.1 1.0 CD B:GLU53 3.1 19.7 1.0 CE1 B:HIS56 3.3 17.2 1.0 HB2 B:HIS56 3.4 16.0 1.0 HE1 B:HIS56 3.4 17.0 1.0 HA B:GLU53 3.4 15.8 1.0 CG B:HIS56 3.5 17.0 1.0 OE1 A:GLU124 3.6 26.6 1.0 OE2 B:GLU53 3.7 22.5 1.0 FE A:FE201 3.8 21.2 0.6 CB B:HIS56 3.8 15.2 1.0 O A:HOH325 3.8 21.1 0.5 HB3 B:HIS56 3.8 15.9 1.0 CG B:GLU20 3.9 25.6 1.0 HE2 A:TYR98 4.0 22.4 1.0 OE1 A:GLU93 4.0 33.4 1.0 HE1 A:HIS127 4.1 17.1 1.0 CG A:GLU124 4.1 22.6 1.0 HG2 A:GLU124 4.2 22.6 1.0 HG3 B:GLU20 4.2 26.0 1.0 HG3 A:GLU124 4.3 22.6 1.0 HB3 B:GLU53 4.3 16.6 1.0 CG B:GLU53 4.3 18.1 1.0 CA B:GLU53 4.3 15.9 1.0 HD1 A:HIS127 4.3 17.9 0.0 HB3 B:GLU20 4.4 21.4 1.0 HA B:GLU20 4.5 18.1 1.0 NE2 B:HIS56 4.5 16.6 1.0 HG2 B:GLU20 4.5 25.9 1.0 CB B:GLU53 4.5 16.2 1.0 CD2 B:HIS56 4.6 16.8 1.0 OH A:TYR98 4.6 21.4 1.0 CB B:GLU20 4.7 21.2 1.0 HD12 A:LEU120 4.7 21.0 1.0 CE1 A:HIS127 4.7 17.3 1.0 HB3 A:LEU120 4.8 19.9 1.0 CE2 A:TYR98 4.8 23.4 1.0 HG3 B:GLU53 4.8 18.0 1.0 ND1 A:HIS127 4.8 17.2 1.0 N B:GLU53 5.0 15.4 1.0 HG2 B:GLU53 5.0 18.0 1.0

Iron binding site 5 out of 12 in the Rubrerythrin From B. Pseudomallei: Iron-Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 5 of Rubrerythrin From B. Pseudomallei: Iron-Bound within 5.0Å range: probe atom residue distance (Å) B Occ C:Fe201 b:21.6 occ:0.59 HD1 C:HIS127 1.3 18.2 0.0 OE1 C:GLU124 1.9 27.2 1.0 OE2 C:GLU90 2.0 23.8 1.0 OE2 D:GLU53 2.0 21.2 1.0 ND1 C:HIS127 2.2 18.0 1.0 O D:HOH313 2.5 6.8 0.5 OE1 C:GLU90 2.5 34.0 1.0 CD C:GLU90 2.5 27.3 1.0 CD D:GLU53 2.9 18.0 1.0 CD C:GLU124 2.9 24.4 1.0 OE1 D:GLU53 3.1 20.1 1.0 CE1 C:HIS127 3.2 18.5 1.0 CG C:HIS127 3.3 17.9 1.0 HE1 C:HIS127 3.3 18.3 1.0 HE2 D:TYR27 3.3 19.2 1.0 HB2 C:HIS127 3.3 17.7 1.0 OE2 C:GLU124 3.4 30.8 1.0 HB3 C:HIS127 3.5 17.8 1.0 CB C:HIS127 3.6 17.7 1.0 HA C:GLU124 3.6 16.4 1.0 HG23 D:THR49 3.9 17.1 1.0 CG C:GLU90 4.0 25.0 1.0 O D:HOH313 4.1 22.0 0.5 HG22 D:THR49 4.2 17.1 1.0 CE2 D:TYR27 4.2 19.4 1.0 OH D:TYR27 4.2 20.1 1.0 HG21 D:THR49 4.2 17.1 1.0 FE D:FE202 4.2 58.0 0.5 CG C:GLU124 4.3 21.1 1.0 HG3 C:GLU90 4.3 24.7 1.0 CG D:GLU53 4.3 17.2 1.0 CG2 D:THR49 4.3 16.8 1.0 NE2 C:HIS127 4.3 18.2 1.0 CD2 C:HIS127 4.4 17.5 1.0 HG2 C:GLU90 4.4 24.6 1.0 HG3 D:GLU53 4.5 17.1 1.0 HD2 D:HIS56 4.5 18.8 1.0 CA C:GLU124 4.5 16.6 1.0 HG2 D:GLU53 4.6 17.0 1.0 HB3 C:GLU124 4.6 18.3 1.0 HE2 C:TYR131 4.6 19.0 1.0 HG3 C:GLU124 4.6 21.1 1.0 CB C:GLU124 4.7 17.9 1.0 CZ D:TYR27 4.7 19.4 1.0 OE1 C:GLU93 4.8 37.9 1.0 HB3 C:GLU90 4.8 21.8 1.0 HH D:TYR27 4.9 20.1 0.0 HG2 C:GLU124 4.9 21.0 1.0 HE2 D:HIS56 4.9 20.9 0.0 HB1 D:ALA23 4.9 16.9 1.0 HA C:GLU90 5.0 18.9 1.0 CB C:GLU90 5.0 21.8 1.0 OE2 C:GLU93 5.0 39.5 1.0

Iron binding site 6 out of 12 in the Rubrerythrin From B. Pseudomallei: Iron-Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 6 of Rubrerythrin From B. Pseudomallei: Iron-Bound within 5.0Å range: probe atom residue distance (Å) B Occ C:Fe202 b:36.2 occ:0.22 HD1 C:HIS56 1.1 20.9 0.0 OE1 C:GLU53 1.9 28.2 1.0 OE2 D:GLU124 1.9 34.0 1.0 ND1 C:HIS56 2.0 20.4 1.0 OE2 C:GLU20 2.2 39.5 1.0 CE1 C:HIS56 2.9 20.1 1.0 CD C:GLU20 2.9 39.5 1.0 CD D:GLU124 3.0 27.8 1.0 CG C:HIS56 3.0 19.6 1.0 CD C:GLU53 3.1 23.4 1.0 HE1 C:HIS56 3.1 20.4 1.0 HA C:GLU53 3.1 17.8 1.0 HB2 C:HIS56 3.1 19.4 1.0 OE1 D:GLU124 3.4 30.3 1.0 OE1 C:GLU20 3.4 52.0 1.0 CB C:HIS56 3.4 19.4 1.0 HB3 C:HIS56 3.5 19.4 1.0 OE2 C:GLU53 3.6 27.3 1.0 FE D:FE201 3.8 27.5 0.8 O C:HOH345 3.8 27.6 1.0 HE1 D:HIS127 3.9 22.3 1.0 HG3 C:GLU20 4.0 30.9 1.0 CA C:GLU53 4.0 17.7 1.0 NE2 C:HIS56 4.0 21.1 1.0 CG C:GLU20 4.0 30.9 1.0 CD2 C:HIS56 4.1 19.6 1.0 HD1 D:HIS127 4.2 18.2 0.0 HD12 D:LEU120 4.2 25.9 1.0 CG C:GLU53 4.2 20.4 1.0 CG D:GLU124 4.3 24.9 1.0 HG2 D:GLU124 4.3 25.0 1.0 HB3 C:GLU53 4.3 18.9 1.0 HE2 D:TYR98 4.4 30.4 1.0 CB C:GLU53 4.4 18.8 1.0 HB3 C:GLU20 4.4 25.6 1.0 CE1 D:HIS127 4.5 23.4 1.0 HG3 D:GLU124 4.5 25.1 1.0 N C:GLU53 4.5 17.1 1.0 OE1 D:GLU93 4.6 37.4 1.0 ND1 D:HIS127 4.6 20.0 1.0 O C:GLY52 4.7 17.8 1.0 OH D:TYR98 4.7 29.9 1.0 HA C:GLU20 4.8 22.6 1.0 CB C:GLU20 4.8 24.6 1.0 HG2 C:GLU20 4.8 30.9 1.0 C C:GLY52 4.8 18.3 1.0 HE2 C:HIS56 4.8 21.5 0.0 HG2 C:GLU53 4.8 20.7 1.0 HG3 C:GLU53 4.8 20.7 1.0 H C:HIS56 4.9 19.2 1.0 HB3 D:LEU120 4.9 23.8 1.0 CA C:HIS56 4.9 19.1 1.0 HD2 C:HIS56 5.0 19.9 1.0

Iron binding site 7 out of 12 in the Rubrerythrin From B. Pseudomallei: Iron-Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 7 of Rubrerythrin From B. Pseudomallei: Iron-Bound within 5.0Å range: probe atom residue distance (Å) B Occ D:Fe201 b:27.5 occ:0.82 HD1 D:HIS127 1.4 18.2 0.0 OE1 D:GLU124 1.8 30.3 1.0 OE2 C:GLU53 2.1 27.3 1.0 OE2 D:GLU90 2.1 30.2 1.0 ND1 D:HIS127 2.3 20.0 1.0 OE1 D:GLU90 2.5 49.9 1.0 CD D:GLU90 2.6 36.2 1.0 O C:HOH345 2.7 27.6 1.0 CD D:GLU124 2.9 27.8 1.0 CD C:GLU53 3.0 23.4 1.0 OE1 C:GLU53 3.2 28.2 1.0 CE1 D:HIS127 3.3 23.4 1.0 CG D:HIS127 3.3 21.9 1.0 HB2 D:HIS127 3.3 22.5 1.0 OE2 D:GLU124 3.3 34.0 1.0 HE1 D:HIS127 3.4 22.3 1.0 HB3 D:HIS127 3.4 22.5 1.0 HE2 C:TYR27 3.5 20.4 1.0 CB D:HIS127 3.6 22.4 1.0 HA D:GLU124 3.7 22.9 1.0 FE C:FE202 3.8 36.2 0.2 HG23 C:THR49 3.9 19.7 1.0 HG22 C:THR49 4.0 19.7 1.0 OH C:TYR27 4.1 23.8 1.0 CG D:GLU90 4.1 32.0 1.0 CG D:GLU124 4.2 24.9 1.0 CG2 C:THR49 4.3 19.3 1.0 HG21 C:THR49 4.3 19.7 1.0 CE2 C:TYR27 4.3 20.4 1.0 CG C:GLU53 4.4 20.4 1.0 NE2 D:HIS127 4.4 22.3 1.0 CD2 D:HIS127 4.4 21.3 1.0 HB3 D:GLU124 4.4 23.3 1.0 HG3 D:GLU90 4.5 32.1 1.0 OE1 D:GLU93 4.5 37.4 1.0 CA D:GLU124 4.5 23.2 1.0 HG2 C:GLU53 4.5 20.7 1.0 HG2 D:GLU90 4.5 32.0 1.0 HD1 C:HIS56 4.6 20.9 0.0 HG3 D:GLU124 4.6 25.1 1.0 HG3 C:GLU53 4.6 20.7 1.0 CB D:GLU124 4.6 22.6 1.0 HE1 C:HIS56 4.7 20.4 1.0 HE2 D:TYR131 4.7 21.8 1.0 HH C:TYR27 4.7 24.6 0.0 CZ C:TYR27 4.7 21.4 1.0 HB3 D:GLU90 4.8 29.2 1.0 HG2 D:GLU124 4.8 25.0 1.0 O C:HOH342 4.8 43.6 1.0 HA D:GLU90 4.9 27.0 1.0 HB1 C:ALA23 5.0 17.7 1.0

Iron binding site 8 out of 12 in the Rubrerythrin From B. Pseudomallei: Iron-Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 8 of Rubrerythrin From B. Pseudomallei: Iron-Bound within 5.0Å range: probe atom residue distance (Å) B Occ D:Fe202 b:58.0 occ:0.46 OE1 D:GLU20 1.8 35.8 1.0 HD2 D:HIS56 1.8 18.8 1.0 OE2 C:GLU124 1.9 30.8 1.0 OE2 D:GLU20 2.1 34.1 1.0 CD D:GLU20 2.2 32.3 1.0 OE1 D:GLU53 2.6 20.1 1.0 CD2 D:HIS56 2.6 18.3 1.0 O D:HOH313 2.8 22.0 0.5 CD C:GLU124 3.1 24.4 1.0 HB2 D:HIS56 3.2 17.4 1.0 CG D:HIS56 3.3 17.2 1.0 HB3 D:HIS56 3.4 17.3 1.0 HA D:GLU53 3.5 14.9 1.0 CB D:HIS56 3.5 17.6 1.0 CD D:GLU53 3.6 18.0 1.0 HE2 C:TYR98 3.6 20.8 1.0 CG D:GLU20 3.6 26.2 1.0 NE2 D:HIS56 3.7 20.1 1.0 OE1 C:GLU124 3.7 27.2 1.0 O D:HOH313 3.7 6.8 0.5 HD12 C:LEU120 3.8 20.7 1.0 OE1 C:GLU93 3.9 37.9 1.0 HG3 D:GLU20 3.9 26.8 1.0 HE2 D:HIS56 3.9 20.9 0.0 OE2 D:GLU53 4.1 21.2 1.0 HG2 D:GLU20 4.2 26.6 1.0 CG C:GLU124 4.2 21.1 1.0 HG2 C:GLU124 4.2 21.0 1.0 OH C:TYR98 4.2 19.2 1.0 HA D:GLU20 4.2 21.0 1.0 FE C:FE201 4.2 21.6 0.6 HG3 C:GLU124 4.2 21.1 1.0 HB3 D:GLU53 4.3 15.9 1.0 HB3 D:GLU20 4.3 23.5 1.0 CE2 C:TYR98 4.4 21.5 1.0 CA D:GLU53 4.4 14.9 1.0 CB D:GLU20 4.5 23.3 1.0 ND1 D:HIS56 4.5 19.8 1.0 CG D:GLU53 4.6 17.2 1.0 CB D:GLU53 4.6 15.8 1.0 HE1 C:HIS127 4.6 18.3 1.0 CE1 D:HIS56 4.7 18.5 1.0 HB3 C:LEU120 4.7 19.7 1.0 CZ C:TYR98 4.7 21.1 1.0 CD1 C:LEU120 4.8 20.7 1.0 HD1 C:HIS127 4.8 18.2 0.0 HH C:TYR98 4.9 18.8 0.0 CA D:GLU20 4.9 21.3 1.0 HD13 C:LEU120 5.0 20.8 1.0 CD C:GLU93 5.0 30.9 1.0

Iron binding site 9 out of 12 in the Rubrerythrin From B. Pseudomallei: Iron-Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 9 of Rubrerythrin From B. Pseudomallei: Iron-Bound within 5.0Å range: probe atom residue distance (Å) B Occ E:Fe201 b:23.7 occ:0.74 HD1 E:HIS127 1.2 15.8 0.0 OE2 F:GLU53 2.0 24.3 1.0 ND1 E:HIS127 2.1 16.8 1.0 OE1 E:GLU124 2.1 27.4 1.0 OE1 E:GLU90 2.4 42.3 1.0 OE2 E:GLU90 2.4 58.1 1.0 OE2 E:GLU124 2.6 26.7 1.0 CD E:GLU124 2.7 26.5 1.0 CD E:GLU90 2.7 40.0 1.0 O F:HOH338 2.7 28.6 1.0 CD F:GLU53 2.9 24.1 1.0 CE1 E:HIS127 3.0 18.0 1.0 HE1 E:HIS127 3.1 17.9 1.0 CG E:HIS127 3.2 17.5 1.0 OE1 F:GLU53 3.2 29.4 1.0 HB2 E:HIS127 3.4 18.3 1.0 HE2 F:TYR27 3.4 21.5 1.0 HB3 E:HIS127 3.4 18.4 1.0 CB E:HIS127 3.6 18.3 1.0 HA E:GLU124 3.7 20.8 1.0 HG23 F:THR49 3.8 19.1 1.0 FE F:FE202 3.8 88.8 0.5 OH F:TYR27 4.0 24.9 1.0 HG22 F:THR49 4.1 19.1 1.0 HG21 F:THR49 4.1 19.1 1.0 CG E:GLU90 4.2 33.6 1.0 CG E:GLU124 4.2 24.4 1.0 CG2 F:THR49 4.2 18.8 1.0 NE2 E:HIS127 4.2 18.7 1.0 CE2 F:TYR27 4.2 21.9 1.0 CD2 E:HIS127 4.3 18.6 1.0 CG F:GLU53 4.3 22.9 1.0 HG2 F:GLU53 4.5 23.1 1.0 HG3 F:GLU53 4.5 23.1 1.0 HG3 E:GLU90 4.5 33.4 1.0 HB3 E:GLU90 4.6 27.9 1.0 HH F:TYR27 4.6 25.4 0.0 HG3 E:GLU124 4.6 24.1 1.0 OE2 E:GLU93 4.6 37.8 1.0 HD1 F:HIS56 4.6 20.1 0.0 CZ F:TYR27 4.6 21.9 1.0 CA E:GLU124 4.6 20.5 1.0 O F:HOH326 4.7 44.4 1.0 HE2 E:TYR131 4.7 20.3 1.0 HG2 E:GLU124 4.7 24.0 1.0 HG2 E:GLU90 4.7 33.1 1.0 CB E:GLU124 4.8 21.1 1.0 HE1 F:HIS56 4.8 19.6 1.0 HB3 E:GLU124 4.9 21.7 1.0 CB E:GLU90 4.9 27.3 1.0

Iron binding site 10 out of 12 in the Rubrerythrin From B. Pseudomallei: Iron-Bound


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 10 of Rubrerythrin From B. Pseudomallei: Iron-Bound within 5.0Å range: probe atom residue distance (Å) B Occ E:Fe202 b:66.2 occ:0.43 HD1 E:HIS56 1.7 17.8 0.0 OE1 E:GLU53 1.8 25.5 1.0 OE2 E:GLU20 2.0 43.5 1.0 OE2 F:GLU124 2.2 34.0 1.0 CD E:GLU20 2.4 33.3 1.0 OE1 E:GLU20 2.5 44.9 1.0 ND1 E:HIS56 2.6 18.1 1.0 CD E:GLU53 2.9 23.1 1.0 O F:HOH331 3.1 32.6 1.0 HA E:GLU53 3.2 20.6 1.0 CD F:GLU124 3.3 31.0 1.0 HB2 E:HIS56 3.3 19.0 1.0 OE2 E:GLU53 3.4 23.7 1.0 CE1 E:HIS56 3.5 19.1 1.0 CG E:HIS56 3.5 18.4 1.0 HE1 E:HIS56 3.6 18.6 1.0 FE F:FE201 3.7 31.8 0.9 CG E:GLU20 3.7 29.0 1.0 HB3 E:HIS56 3.7 19.0 1.0 CB E:HIS56 3.7 18.9 1.0 HG3 E:GLU20 4.0 28.8 1.0 HB3 E:GLU20 4.0 24.9 1.0 OE1 F:GLU124 4.0 34.4 1.0 HB3 E:GLU53 4.0 21.8 1.0 CG E:GLU53 4.0 22.5 1.0 CA E:GLU53 4.1 20.6 1.0 HE2 F:TYR98 4.1 29.0 1.0 OE1 F:GLU93 4.2 39.5 1.0 HE1 F:HIS127 4.2 23.8 1.0 CB E:GLU53 4.3 22.1 1.0 HA E:GLU20 4.3 22.9 1.0 HG2 F:GLU124 4.3 28.8 1.0 HD1 F:HIS127 4.3 23.3 0.0 CG F:GLU124 4.3 28.6 1.0 CB E:GLU20 4.4 24.3 1.0 HG3 F:GLU124 4.4 28.8 1.0 HG2 E:GLU20 4.4 28.6 1.0 HG3 E:GLU53 4.5 22.5 1.0 NE2 E:HIS56 4.6 18.0 1.0 CD2 E:HIS56 4.7 17.9 1.0 OH F:TYR98 4.7 26.7 1.0 HG2 E:GLU53 4.7 22.5 1.0 N E:GLU53 4.8 20.3 1.0 HB3 E:ALA23 4.8 19.2 1.0 CE1 F:HIS127 4.8 24.4 1.0 HG F:LEU120 4.9 26.6 1.0 ND1 F:HIS127 4.9 23.1 1.0 CA E:GLU20 4.9 22.8 1.0 CE2 F:TYR98 4.9 29.5 1.0

D.C.F.Monteiro, M.E.Snell, G.R.Budziszewski, S.E.J.Bowman. Rubrerythrin From B. Pseudomallei: Iron-Bound To Be Published.