Iron in PDB 3eqe: Crystal Structure of the Yubc Protein From Bacillus Subtilis. Northeast Structural Genomics Consortium Target SR112.

The structure of Crystal Structure of the Yubc Protein From Bacillus Subtilis. Northeast Structural Genomics Consortium Target SR112., PDB code: 3eqe was solved by S.M.Vorobiev, M.Su, J.Seetharaman, J.Benach, F.Forouhar, G.Clayton, B.Cooper, H.Wang, E.L.Foote, C.Ciccosanti, L.Mao, R.Xiao, T.B.Acton, G.T.Montelione, J.F.Hunt, L.Tong, Northeast Structural Genomicsconsortium (Nesg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	46.51 / 2.82
Space group	P 43 2 2
Cell size a, b, c (Å), α, β, γ (°)	65.830, 65.830, 197.190, 90.00, 90.00, 90.00
R / Rfree (%)	24.1 / 29.6

The binding sites of Iron atom in the Crystal Structure of the Yubc Protein From Bacillus Subtilis. Northeast Structural Genomics Consortium Target SR112. (pdb code 3eqe). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 2 binding sites of Iron where determined in the Crystal Structure of the Yubc Protein From Bacillus Subtilis. Northeast Structural Genomics Consortium Target SR112., PDB code: 3eqe:
Jump to Iron binding site number: 1; 2;

Iron binding site 1 out of 2 in the Crystal Structure of the Yubc Protein From Bacillus Subtilis. Northeast Structural Genomics Consortium Target SR112.


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 the Yubc Protein From Bacillus Subtilis. Northeast Structural Genomics Consortium Target SR112. within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe202 b:54.9 occ:1.00 NE2 A:HIS125 2.3 54.7 1.0 NE2 A:HIS75 2.4 62.0 1.0 NE2 A:HIS77 2.6 63.8 1.0 CD2 A:HIS77 3.1 64.0 1.0 CE1 A:HIS125 3.1 56.0 1.0 CE1 A:HIS75 3.3 62.4 1.0 O A:HOH319 3.3 37.0 1.0 CD2 A:HIS75 3.4 62.5 1.0 CD2 A:HIS125 3.5 55.8 1.0 OH A:TYR141 3.6 57.6 1.0 CE1 A:HIS77 3.8 66.4 1.0 ND1 A:HIS125 4.3 58.3 1.0 CG A:HIS77 4.4 65.2 1.0 ND1 A:HIS75 4.4 63.2 1.0 CE1 A:TYR141 4.4 55.2 1.0 CG A:HIS75 4.5 62.2 1.0 CZ A:TYR141 4.5 55.0 1.0 CG A:HIS125 4.5 56.5 1.0 O A:HOH302 4.6 46.8 1.0 ND1 A:HIS77 4.7 66.6 1.0 SE A:MSE127 4.9 85.5 1.0 OG A:SER119 4.9 60.1 1.0

Iron binding site 2 out of 2 in the Crystal Structure of the Yubc Protein From Bacillus Subtilis. Northeast Structural Genomics Consortium Target SR112.


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of Crystal Structure of the Yubc Protein From Bacillus Subtilis. Northeast Structural Genomics Consortium Target SR112. within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe201 b:65.8 occ:1.00 NE2 B:HIS77 2.2 72.0 1.0 NE2 B:HIS75 2.5 75.0 1.0 O B:HOH311 2.7 39.4 1.0 NE2 B:HIS125 2.7 78.0 1.0 CE1 B:HIS77 2.9 72.8 1.0 CE1 B:HIS125 3.2 78.9 1.0 CD2 B:HIS77 3.2 72.4 1.0 OH B:TYR141 3.3 60.6 1.0 O B:HOH313 3.3 31.3 1.0 CE1 B:HIS75 3.4 75.4 1.0 CD2 B:HIS75 3.4 74.9 1.0 CE B:MSE148 3.9 98.8 1.0 CD2 B:HIS125 4.0 78.0 1.0 ND1 B:HIS77 4.0 73.9 1.0 CG B:HIS77 4.2 72.1 1.0 O B:HOH303 4.3 39.8 1.0 CZ B:TYR141 4.3 56.9 1.0 ND1 B:HIS125 4.4 78.5 1.0 CE1 B:TYR141 4.5 56.1 1.0 ND1 B:HIS75 4.6 76.1 1.0 CG B:HIS75 4.6 75.2 1.0 CG B:HIS125 4.8 78.4 1.0 SE B:MSE127 5.0 95.4 1.0

S.M.Vorobiev, M.Su, J.Seetharaman, J.Benach, F.Forouhar, G.Clayton, B.Cooper, H.Wang, E.L.Foote, C.Ciccosanti, L.Mao, R.Xiao, T.B.Acton, G.T.Montelione, J.F.Hunt, L.Tong. Crystal Structure of the Yubc Protein From Bacillus Subtilis. To Be Published.