Iron in PDB 3mjn: Crystal Structure of the Complex of C-Lobe of Lactoferrin with Isopropylamino-3-(1-Naphthyloxy)Propan-2-Ol at 2.38 A Resolution

The structure of Crystal Structure of the Complex of C-Lobe of Lactoferrin with Isopropylamino-3-(1-Naphthyloxy)Propan-2-Ol at 2.38 A Resolution, PDB code: 3mjn was solved by K.Srivastava, G.Vikram, S.Kaushik, M.Sinha, P.Kaur, S.Sharma, T.P.Singh, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	62.50 / 2.38
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	63.107, 50.248, 65.654, 90.00, 107.82, 90.00
R / Rfree (%)	17.1 / 21.1

The structure of Crystal Structure of the Complex of C-Lobe of Lactoferrin with Isopropylamino-3-(1-Naphthyloxy)Propan-2-Ol at 2.38 A Resolution also contains other interesting chemical elements:

Zinc

(Zn)

2 atoms

The binding sites of Iron atom in the Crystal Structure of the Complex of C-Lobe of Lactoferrin with Isopropylamino-3-(1-Naphthyloxy)Propan-2-Ol at 2.38 A Resolution (pdb code 3mjn). 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 the Complex of C-Lobe of Lactoferrin with Isopropylamino-3-(1-Naphthyloxy)Propan-2-Ol at 2.38 A Resolution, PDB code: 3mjn:

Iron binding site 1 out of 1 in the Crystal Structure of the Complex of C-Lobe of Lactoferrin with Isopropylamino-3-(1-Naphthyloxy)Propan-2-Ol at 2.38 A Resolution


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 Complex of C-Lobe of Lactoferrin with Isopropylamino-3-(1-Naphthyloxy)Propan-2-Ol at 2.38 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe1001 b:20.4 occ:1.00 OH A:TYR526 1.9 17.1 1.0 OD1 A:ASP395 2.0 15.2 1.0 OH A:TYR433 2.0 20.8 1.0 O2 A:CO31002 2.1 14.7 1.0 NE2 A:HIS595 2.3 16.4 1.0 O1 A:CO31002 2.3 13.5 1.0 C A:CO31002 2.5 13.4 1.0 CZ A:TYR433 3.0 22.2 1.0 CZ A:TYR526 3.0 17.2 1.0 CG A:ASP395 3.1 17.1 1.0 CE1 A:HIS595 3.3 15.5 1.0 CD2 A:HIS595 3.3 14.8 1.0 CE1 A:TYR433 3.6 21.9 1.0 CE1 A:TYR526 3.8 16.6 1.0 O3 A:CO31002 3.8 13.4 1.0 CB A:ASP395 3.9 17.4 1.0 O A:HOH26 3.9 21.2 1.0 CE2 A:TYR526 3.9 14.7 1.0 CE2 A:TYR433 4.0 21.3 1.0 O A:HOH45 4.1 20.9 1.0 OD2 A:ASP395 4.1 16.9 1.0 NH2 A:ARG463 4.3 20.1 1.0 ND1 A:HIS595 4.4 16.5 1.0 CG A:HIS595 4.4 16.7 1.0 CB A:THR464 4.5 16.6 1.0 CA A:ASP395 4.6 18.1 1.0 N A:ALA465 4.7 17.4 1.0 N A:THR464 4.7 16.9 1.0 NE A:ARG463 4.7 20.2 1.0 OG1 A:THR464 4.8 17.9 1.0 CD1 A:TYR433 4.9 21.4 1.0 CZ A:ARG463 5.0 20.3 1.0

K.Srivastava, G.Vikram, S.Kaushik, M.Sinha, P.Kaur, S.Sharma, T.P.Singh. Crystal Structure of the Complex of C-Lobe of Lactoferrin with Isopropylamino-3-(1-Naphthyloxy)Propan-2-Ol at 2.38 A Resolution To Be Published.