Iron in PDB 6lnh: Crystal Structure of Ido From Bacillus Thuringiensis

All present enzymatic activity of Crystal Structure of Ido From Bacillus Thuringiensis:
1.14.11.45;

The structure of Crystal Structure of Ido From Bacillus Thuringiensis, PDB code: 6lnh was solved by Y.Feng, J.W.Huang, W.D.Liu, C.C.Chen, R.T.Guo, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	24.86 / 2.34
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	68.425, 120.965, 81.715, 90, 108.11, 90
R / Rfree (%)	22.8 / 26.4

The structure of Crystal Structure of Ido From Bacillus Thuringiensis also contains other interesting chemical elements:

Mercury

(Hg)

7 atoms

The binding sites of Iron atom in the Crystal Structure of Ido From Bacillus Thuringiensis (pdb code 6lnh). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 4 binding sites of Iron where determined in the Crystal Structure of Ido From Bacillus Thuringiensis, PDB code: 6lnh:
Jump to Iron binding site number: 1; 2; 3; 4;

Iron binding site 1 out of 4 in the Crystal Structure of Ido From Bacillus Thuringiensis


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 Ido From Bacillus Thuringiensis within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe304 b:60.2 occ:1.00 O A:HOH418 2.5 30.0 1.0 O A:HOH419 2.6 68.9 1.0 NE2 A:HIS223 2.6 51.1 1.0 NE2 A:HIS170 2.7 56.0 1.0 OD2 A:ASP172 2.9 61.4 1.0 OD1 A:ASP172 2.9 60.9 1.0 CG A:ASP172 3.3 56.1 1.0 CE1 A:HIS170 3.4 50.7 1.0 CD2 A:HIS223 3.5 51.2 1.0 CE1 A:HIS223 3.7 51.1 1.0 CD2 A:HIS170 3.8 48.7 1.0 ND1 A:HIS170 4.7 48.0 1.0 CG A:HIS223 4.7 48.3 1.0 ND1 A:HIS223 4.7 50.0 1.0 CB A:ASP172 4.8 56.1 1.0 CG A:HIS170 4.9 52.3 1.0

Iron binding site 2 out of 4 in the Crystal Structure of Ido From Bacillus Thuringiensis


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 Ido From Bacillus Thuringiensis within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe304 b:48.3 occ:1.00 NE2 B:HIS223 2.2 50.1 1.0 O B:HOH406 2.3 45.3 1.0 NE2 B:HIS170 2.5 48.3 1.0 OD1 B:ASP172 2.6 46.9 1.0 O B:HOH430 2.7 50.2 1.0 OD2 B:ASP172 2.7 53.5 1.0 CG B:ASP172 3.0 45.0 1.0 O B:HOH432 3.0 59.8 1.0 CE1 B:HIS223 3.0 47.3 1.0 CD2 B:HIS223 3.3 43.3 1.0 CE1 B:HIS170 3.4 47.8 1.0 CD2 B:HIS170 3.5 42.7 1.0 ND1 B:HIS223 4.2 44.8 1.0 CG B:HIS223 4.3 43.1 1.0 ND1 B:HIS170 4.5 45.3 1.0 CB B:ASP172 4.5 46.4 1.0 CG B:HIS170 4.6 44.9 1.0

Iron binding site 3 out of 4 in the Crystal Structure of Ido From Bacillus Thuringiensis


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 3 of Crystal Structure of Ido From Bacillus Thuringiensis within 5.0Å range: probe atom residue distance (Å) B Occ C:Fe301 b:48.6 occ:1.00 O C:HOH405 2.4 37.8 1.0 O C:HOH438 2.5 47.8 1.0 O C:HOH437 2.5 45.0 1.0 NE2 C:HIS170 2.6 51.7 1.0 NE2 C:HIS223 2.6 39.1 1.0 CE1 C:HIS170 3.1 43.3 1.0 OD1 C:ASP172 3.3 42.9 1.0 CD2 C:HIS223 3.3 36.1 1.0 OD2 C:ASP172 3.5 42.4 1.0 CE1 C:HIS223 3.7 41.8 1.0 CD2 C:HIS170 3.8 41.0 1.0 CG C:ASP172 3.9 38.3 1.0 ND1 C:HIS170 4.4 47.2 1.0 CG C:HIS223 4.6 39.5 1.0 ND1 C:HIS223 4.7 42.3 1.0 CG C:HIS170 4.7 43.9 1.0

Iron binding site 4 out of 4 in the Crystal Structure of Ido From Bacillus Thuringiensis


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 4 of Crystal Structure of Ido From Bacillus Thuringiensis within 5.0Å range: probe atom residue distance (Å) B Occ D:Fe302 b:58.4 occ:1.00 NE2 D:HIS223 2.2 41.3 1.0 O D:HOH406 2.4 37.8 1.0 NE2 D:HIS170 2.5 48.3 1.0 OD1 D:ASP172 2.5 44.5 1.0 OD2 D:ASP172 2.6 44.4 1.0 CG D:ASP172 2.9 42.3 1.0 CE1 D:HIS223 3.1 45.3 1.0 O D:HOH423 3.2 48.0 1.0 CE1 D:HIS170 3.2 40.8 1.0 CD2 D:HIS223 3.2 37.0 1.0 CD2 D:HIS170 3.6 45.0 1.0 ND1 D:HIS223 4.2 43.0 1.0 CG D:HIS223 4.3 38.2 1.0 CB D:ASP172 4.4 47.6 1.0 ND1 D:HIS170 4.4 42.8 1.0 CG D:HIS170 4.6 48.3 1.0

Y.Feng, J.W.Huang, W.D.Liu, C.C.Chen, R.T.Guo. Crystal Structure of Ido From Bacillus Thuringiensis To Be Published.