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Iron in PDB 11yv: Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 7-((3-(((3-(6-Aminopyridin-2-Yl)Propyl)Amino)Methyl)Phenoxy)Methyl) Quinolin-2-Amine

Enzymatic activity of Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 7-((3-(((3-(6-Aminopyridin-2-Yl)Propyl)Amino)Methyl)Phenoxy)Methyl) Quinolin-2-Amine

All present enzymatic activity of Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 7-((3-(((3-(6-Aminopyridin-2-Yl)Propyl)Amino)Methyl)Phenoxy)Methyl) Quinolin-2-Amine:
1.14.14.47;

Protein crystallography data

The structure of Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 7-((3-(((3-(6-Aminopyridin-2-Yl)Propyl)Amino)Methyl)Phenoxy)Methyl) Quinolin-2-Amine, PDB code: 11yv was solved by V.C.Murarka, T.L.Poulos, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 44.04 / 1.86
Space group P 21 21 2
Cell size a, b, c (Å), α, β, γ (°) 81.174, 94.657, 62.966, 90, 90, 90
R / Rfree (%) 16.3 / 19.6

Other elements in 11yv:

The structure of Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 7-((3-(((3-(6-Aminopyridin-2-Yl)Propyl)Amino)Methyl)Phenoxy)Methyl) Quinolin-2-Amine also contains other interesting chemical elements:

Chlorine (Cl) 1 atom

Iron Binding Sites:

The binding sites of Iron atom in the Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 7-((3-(((3-(6-Aminopyridin-2-Yl)Propyl)Amino)Methyl)Phenoxy)Methyl) Quinolin-2-Amine (pdb code 11yv). 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 Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 7-((3-(((3-(6-Aminopyridin-2-Yl)Propyl)Amino)Methyl)Phenoxy)Methyl) Quinolin-2-Amine, PDB code: 11yv:

Iron binding site 1 out of 1 in 11yv

Go back to Iron Binding Sites List in 11yv
Iron binding site 1 out of 1 in the Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 7-((3-(((3-(6-Aminopyridin-2-Yl)Propyl)Amino)Methyl)Phenoxy)Methyl) Quinolin-2-Amine


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 7-((3-(((3-(6-Aminopyridin-2-Yl)Propyl)Amino)Methyl)Phenoxy)Methyl) Quinolin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe401

b:24.0
occ:1.00
 FE A:HEM401 0.0 24.0 1.0
ND A:HEM401 2.0 22.6 1.0
NA A:HEM401 2.1 21.9 1.0
NC A:HEM401 2.1 22.9 1.0
NB A:HEM401 2.1 23.4 1.0
SG A:CYS66 2.5 22.9 1.0
C1D A:HEM401 3.1 26.4 1.0
C4A A:HEM401 3.1 22.9 1.0
C1B A:HEM401 3.1 22.1 1.0
C4C A:HEM401 3.1 23.0 1.0
C4D A:HEM401 3.1 26.0 1.0
C1C A:HEM401 3.1 23.1 1.0
C4B A:HEM401 3.1 24.3 1.0
C1A A:HEM401 3.1 26.1 1.0
CB A:CYS66 3.4 23.6 1.0
CHB A:HEM401 3.4 25.5 1.0
CHD A:HEM401 3.4 24.5 1.0
CHC A:HEM401 3.5 24.9 1.0
CHA A:HEM401 3.5 25.2 1.0
C05 A:V5D402 3.7 23.8 1.0
C04 A:V5D402 3.7 25.6 1.0
C03 A:V5D402 4.0 25.8 1.0
C06 A:V5D402 4.1 25.4 1.0
CA A:CYS66 4.2 24.0 1.0
C2D A:HEM401 4.3 27.5 1.0
C3A A:HEM401 4.3 22.9 1.0
C2B A:HEM401 4.3 21.6 1.0
C3D A:HEM401 4.3 25.4 1.0
C2C A:HEM401 4.3 24.9 1.0
C3C A:HEM401 4.3 22.4 1.0
C3B A:HEM401 4.3 24.2 1.0
C2A A:HEM401 4.3 22.8 1.0
C02 A:V5D402 4.4 23.0 1.0
N32 A:V5D402 4.4 24.3 1.0
NE1 A:TRP60 4.5 24.9 1.0
C07 A:V5D402 4.8 25.9 1.0
N A:GLY68 4.9 25.0 1.0
C A:CYS66 4.9 26.6 1.0

Reference:

V.C.Murarka, T.L.Poulos. Anti-Mrsa Inhibitors Targeting Bacterial Nitric Oxide Synthase To Be Published.
Page generated: Sun Oct 4 08:33:14 2026

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