Iron in PDB 1rb9: Rubredoxin From Desulfovibrio Vulgaris Refined Anisotropically at 0.92 Angstroms Resolution

The structure of Rubredoxin From Desulfovibrio Vulgaris Refined Anisotropically at 0.92 Angstroms Resolution, PDB code: 1rb9 was solved by Z.Dauter, S.Butterworth, L.C.Sieker, G.Sheldrick, K.S.Wilson, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	20.00 / 0.92
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	19.970, 41.450, 24.410, 90.00, 108.30, 90.00
R / Rfree (%)	n/a / n/a

The binding sites of Iron atom in the Rubredoxin From Desulfovibrio Vulgaris Refined Anisotropically at 0.92 Angstroms Resolution (pdb code 1rb9). 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 Rubredoxin From Desulfovibrio Vulgaris Refined Anisotropically at 0.92 Angstroms Resolution, PDB code: 1rb9:

Iron binding site 1 out of 1 in the Rubredoxin From Desulfovibrio Vulgaris Refined Anisotropically at 0.92 Angstroms Resolution


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Rubredoxin From Desulfovibrio Vulgaris Refined Anisotropically at 0.92 Angstroms Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe54 b:5.0 occ:1.00 SG A:CYS42 2.2 5.9 1.0 SG A:CYS9 2.3 6.0 1.0 SG A:CYS6 2.3 5.1 1.0 SG A:CYS39 2.3 5.3 1.0 HB3 A:CYS42 3.2 7.8 1.0 HB3 A:CYS39 3.2 6.1 1.0 CB A:CYS39 3.2 5.0 1.0 HB3 A:CYS6 3.2 5.8 1.0 CB A:CYS6 3.2 4.8 1.0 HB3 A:CYS9 3.2 7.3 1.0 H A:CYS9 3.2 6.6 1.0 HB2 A:CYS39 3.3 6.1 1.0 CB A:CYS42 3.3 6.5 1.0 HB2 A:CYS6 3.3 5.8 1.0 CB A:CYS9 3.4 6.1 1.0 H A:CYS42 3.4 7.8 1.0 HB3 A:TYR11 3.5 8.1 1.0 HB A:VAL8 3.6 6.4 1.0 HB2 A:ALA44 3.7 15.2 1.0 N A:CYS9 3.8 5.5 1.0 N A:CYS42 3.9 6.5 1.0 HB A:VAL41 3.9 8.6 1.0 H A:TYR11 4.0 7.3 1.0 H A:ALA44 4.0 8.2 1.0 HB2 A:CYS42 4.1 7.8 1.0 CA A:CYS42 4.1 6.3 1.0 CA A:CYS9 4.1 5.5 1.0 HB2 A:CYS9 4.1 7.3 1.0 HB1 A:ALA44 4.2 15.2 1.0 HB2 A:TYR11 4.3 8.1 1.0 CB A:TYR11 4.4 6.8 1.0 CB A:ALA44 4.4 10.2 1.0 H A:GLY10 4.4 6.7 1.0 H A:GLY43 4.5 7.7 1.0 CB A:VAL8 4.5 5.3 1.0 H A:VAL41 4.5 8.0 1.0 H A:VAL8 4.6 5.9 1.0 CA A:CYS6 4.6 4.3 1.0 CA A:CYS39 4.6 5.2 1.0 HZ A:PHE49 4.6 8.1 1.0 HG11 A:VAL8 4.7 12.1 1.0 C A:CYS9 4.7 5.8 1.0 CB A:VAL41 4.8 7.2 1.0 C A:CYS42 4.8 6.2 1.0 N A:TYR11 4.8 6.1 1.0 C A:VAL41 4.8 6.5 1.0 N A:GLY10 4.8 5.6 1.0 C A:VAL8 4.8 5.2 1.0 HG11 A:VAL41 4.8 14.0 1.0 N A:GLY43 4.8 6.5 1.0 N A:ALA44 4.8 6.8 1.0 HA A:CYS42 4.9 7.5 1.0 HA A:CYS39 4.9 6.2 1.0 HA A:CYS9 4.9 6.5 1.0 HA A:CYS6 4.9 5.2 1.0 HD2 A:TYR11 5.0 9.0 1.0

Z.Dauter, S.Butterworth, L.C.Sieker, G.Sheldrick, K.S.Wilson. Anisotropic Refinement of Rubredoxin From Desulfovibrio Vulgaris To Be Published.