Atomistry » Zinc » PDB 5fi5-5fpa » 5fj2
Atomistry »
  Zinc »
    PDB 5fi5-5fpa »
      5fj2 »

Zinc in PDB 5fj2: Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with 7-((4-Chloro-3-(( Methylamino)Methyl)Phenoxy)Methyl)Quinolin-2-Amine

Enzymatic activity of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with 7-((4-Chloro-3-(( Methylamino)Methyl)Phenoxy)Methyl)Quinolin-2-Amine

All present enzymatic activity of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with 7-((4-Chloro-3-(( Methylamino)Methyl)Phenoxy)Methyl)Quinolin-2-Amine:
1.14.13.39;

Protein crystallography data

The structure of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with 7-((4-Chloro-3-(( Methylamino)Methyl)Phenoxy)Methyl)Quinolin-2-Amine, PDB code: 5fj2 was solved by H.Li, T.L.Poulos, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 39.060 / 2.05
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 57.734, 106.002, 156.241, 90.00, 90.00, 90.00
R / Rfree (%) 17.33 / 22.06

Other elements in 5fj2:

The structure of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with 7-((4-Chloro-3-(( Methylamino)Methyl)Phenoxy)Methyl)Quinolin-2-Amine also contains other interesting chemical elements:

Arsenic (As) 2 atoms
Iron (Fe) 2 atoms
Chlorine (Cl) 2 atoms

Zinc Binding Sites:

The binding sites of Zinc atom in the Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with 7-((4-Chloro-3-(( Methylamino)Methyl)Phenoxy)Methyl)Quinolin-2-Amine (pdb code 5fj2). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total only one binding site of Zinc was determined in the Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with 7-((4-Chloro-3-(( Methylamino)Methyl)Phenoxy)Methyl)Quinolin-2-Amine, PDB code: 5fj2:

Zinc binding site 1 out of 1 in 5fj2

Go back to Zinc Binding Sites List in 5fj2
Zinc binding site 1 out of 1 in the Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with 7-((4-Chloro-3-(( Methylamino)Methyl)Phenoxy)Methyl)Quinolin-2-Amine


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with 7-((4-Chloro-3-(( Methylamino)Methyl)Phenoxy)Methyl)Quinolin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Zn901

b:41.0
occ:1.00
 SG A:CYS101 2.4 35.6 1.0
SG B:CYS101 2.4 36.0 1.0
SG A:CYS96 2.4 38.6 1.0
SG B:CYS96 2.4 37.2 1.0
CB B:CYS101 3.2 31.6 1.0
CB A:CYS101 3.2 36.3 1.0
CB B:CYS96 3.4 35.4 1.0
CB A:CYS96 3.4 38.1 1.0
CA A:CYS101 3.7 42.3 1.0
CA B:CYS101 3.7 37.5 1.0
N B:GLY103 4.1 45.7 1.0
N B:LEU102 4.1 37.8 1.0
N A:GLY103 4.1 46.5 1.0
N A:LEU102 4.2 43.4 1.0
C B:CYS101 4.3 38.3 1.0
C A:CYS101 4.3 43.7 1.0
CA A:GLY103 4.4 42.8 1.0
CA B:GLY103 4.4 44.0 1.0
CA B:CYS96 4.7 39.7 1.0
CA A:CYS96 4.8 43.2 1.0
O B:HOH2188 4.9 43.7 1.0
N A:CYS101 4.9 37.5 1.0
O A:HOH2107 4.9 52.2 1.0
N B:CYS101 4.9 36.3 1.0

Reference:

M.A.Cinelli, H.Li, A.V.Pensa, S.Kang, L.J.Roman, P.Martasek, T.L.Poulos, R.B.Silverman. Phenyl Ether- and Aniline-Containing 2-Aminoquinolines As Potent and Selective Inhibitors of Neuronal Nitric Oxide Synthase. J.Med.Chem. V. 58 8694 2015.
ISSN: ISSN 0022-2623
PubMed: 26469213
DOI: 10.1021/ACS.JMEDCHEM.5B01330
Page generated: Sun Oct 27 16:12:37 2024

Last articles

Zn in 9JYW
Zn in 9IR4
Zn in 9IR3
Zn in 9GMX
Zn in 9GMW
Zn in 9JEJ
Zn in 9ERF
Zn in 9ERE
Zn in 9EGV
Zn in 9EGW
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy