Iron in PDB 5dab: Crystal Structure of Fto-IN115

The structure of Crystal Structure of Fto-IN115, PDB code: 5dab was solved by J.Chai, B.Zhou, W.Liu, Z.Han, T.Niu, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	28.91 / 2.10
Space group	H 3
Cell size a, b, c (Å), α, β, γ (°)	142.681, 142.681, 81.998, 90.00, 90.00, 120.00
R / Rfree (%)	21 / 24.1

The structure of Crystal Structure of Fto-IN115 also contains other interesting chemical elements:

Chlorine

(Cl)

10 atoms

The binding sites of Iron atom in the Crystal Structure of Fto-IN115 (pdb code 5dab). 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 Crystal Structure of Fto-IN115, PDB code: 5dab:

Iron binding site 1 out of 1 in the Crystal Structure of Fto-IN115


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 Fto-IN115 within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe610 b:0.9 occ:1.00 C2 A:AKG611 2.6 75.9 1.0 O5 A:AKG611 2.6 69.6 1.0 O A:HOH762 2.6 62.2 1.0 C3 A:AKG611 2.9 74.7 1.0 CE1 A:HIS231 2.9 50.4 1.0 NE2 A:HIS231 3.1 52.1 1.0 NE2 A:HIS307 3.1 47.2 1.0 C4 A:AKG611 3.2 66.7 1.0 O2 A:AKG611 3.3 82.8 1.0 C1 A:AKG611 3.3 79.8 1.0 CD2 A:HIS307 3.6 51.0 1.0 O A:HOH756 3.7 70.9 1.0 OD1 A:ASP233 4.0 50.8 1.0 ND1 A:HIS231 4.2 56.0 1.0 CE1 A:HIS307 4.3 48.9 1.0 CG2 A:VAL309 4.4 56.8 1.0 CG1 A:VAL228 4.4 51.9 1.0 C5 A:AKG611 4.4 65.2 1.0 O1 A:AKG611 4.4 73.0 1.0 CD2 A:HIS231 4.4 51.8 1.0 CG A:HIS307 4.8 49.4 1.0 CB A:VAL228 4.9 54.2 1.0 O3 A:AKG611 5.0 61.4 1.0

J.Chai, B.Zhou, W.Liu, Z.Han, T.Niu. Crystal Structure of Fto-IN115 To Be Published.