Atomistry » Iron » PDB 5g6e-5h8w » 5g6k
Atomistry »
  Iron »
    PDB 5g6e-5h8w »
      5g6k »

Iron in PDB 5g6k: Structure of Bacillus Subtilis Nitric Oxide Synthase I218V in Complex with 7-((3-(2-(Methylamino)Ethyl)Phenoxy)Methyl)Quinolin-2- Amine

Enzymatic activity of Structure of Bacillus Subtilis Nitric Oxide Synthase I218V in Complex with 7-((3-(2-(Methylamino)Ethyl)Phenoxy)Methyl)Quinolin-2- Amine

All present enzymatic activity of Structure of Bacillus Subtilis Nitric Oxide Synthase I218V in Complex with 7-((3-(2-(Methylamino)Ethyl)Phenoxy)Methyl)Quinolin-2- Amine:
1.14.13.165;

Protein crystallography data

The structure of Structure of Bacillus Subtilis Nitric Oxide Synthase I218V in Complex with 7-((3-(2-(Methylamino)Ethyl)Phenoxy)Methyl)Quinolin-2- Amine, PDB code: 5g6k was solved by J.K.Holden, M.C.Lewis, T.L.Poulos, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 37.77 / 1.95
Space group P 21 21 2
Cell size a, b, c (Å), α, β, γ (°) 80.590, 95.060, 62.220, 90.00, 90.00, 90.00
R / Rfree (%) 16.9 / 21.6

Other elements in 5g6k:

The structure of Structure of Bacillus Subtilis Nitric Oxide Synthase I218V in Complex with 7-((3-(2-(Methylamino)Ethyl)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 I218V in Complex with 7-((3-(2-(Methylamino)Ethyl)Phenoxy)Methyl)Quinolin-2- Amine (pdb code 5g6k). 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 I218V in Complex with 7-((3-(2-(Methylamino)Ethyl)Phenoxy)Methyl)Quinolin-2- Amine, PDB code: 5g6k:

Iron binding site 1 out of 1 in 5g6k

Go back to Iron Binding Sites List in 5g6k
Iron binding site 1 out of 1 in the Structure of Bacillus Subtilis Nitric Oxide Synthase I218V in Complex with 7-((3-(2-(Methylamino)Ethyl)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 I218V in Complex with 7-((3-(2-(Methylamino)Ethyl)Phenoxy)Methyl)Quinolin-2- Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe901

b:22.1
occ:1.00
 FE A:HEM901 0.0 22.1 1.0
ND A:HEM901 1.9 20.8 1.0
NA A:HEM901 2.0 17.9 1.0
NC A:HEM901 2.1 21.3 1.0
NB A:HEM901 2.1 21.5 1.0
SG A:CYS66 2.5 24.9 1.0
C1D A:HEM901 2.9 18.5 1.0
C4D A:HEM901 3.0 22.1 1.0
C4C A:HEM901 3.0 20.8 1.0
C1A A:HEM901 3.0 23.8 1.0
C4A A:HEM901 3.1 18.1 1.0
C1B A:HEM901 3.1 18.7 1.0
C1C A:HEM901 3.1 20.2 1.0
C4B A:HEM901 3.1 20.9 1.0
CB A:CYS66 3.3 23.7 1.0
C04 A:M94904 3.3 32.3 1.0
CHD A:HEM901 3.3 21.5 1.0
CHA A:HEM901 3.5 24.2 1.0
CHB A:HEM901 3.5 17.2 1.0
CHC A:HEM901 3.5 19.6 1.0
C03 A:M94904 3.7 33.1 1.0
C05 A:M94904 3.7 36.6 1.0
C06 A:M94904 4.1 40.3 1.0
CA A:CYS66 4.2 17.7 1.0
C2D A:HEM901 4.2 19.9 1.0
C3D A:HEM901 4.2 20.9 1.0
C3A A:HEM901 4.2 22.8 1.0
C2A A:HEM901 4.3 24.7 1.0
C3C A:HEM901 4.3 21.3 1.0
C2C A:HEM901 4.3 18.2 1.0
C02 A:M94904 4.3 32.3 1.0
C2B A:HEM901 4.3 20.4 1.0
C10 A:M94904 4.4 37.5 1.0
NE1 A:TRP60 4.4 22.9 1.0
C3B A:HEM901 4.4 23.0 1.0
N01 A:M94904 4.6 35.0 1.0
C A:CYS66 4.9 18.6 1.0
N A:GLY68 4.9 22.8 1.0
N A:ILE67 5.0 17.9 1.0

Reference:

J.K.Holden, M.C.Lewis, M.A.Cinelli, Z.Abdullatif, A.V.Pensa, R.B.Silverman, T.L.Poulos. Targeting Bacterial Nitric Oxide Synthase with Aminoquinoline-Based Inhibitors. Biochemistry V. 55 5587 2016.
ISSN: ISSN 1520-4995
PubMed: 27607918
DOI: 10.1021/ACS.BIOCHEM.6B00786
Page generated: Sun Dec 13 16:02:15 2020

Last articles

Zn in 8WB0
Zn in 8WAX
Zn in 8WAU
Zn in 8WAZ
Zn in 8WAY
Zn in 8WAV
Zn in 8WAW
Zn in 8WAT
Zn in 8W7M
Zn in 8WD3
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy