Atomistry » Zinc » PDB 4csz-4cyk » 4ctz
Atomistry »
  Zinc »
    PDB 4csz-4cyk »
      4ctz »

Zinc in PDB 4ctz: Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-6-(2-Amino-2-(3-(2-(4-Methylpyridin-2-Yl) Ethyl)Phenyl)Ethyl)-4-Methylpyridin-2-Amine

Enzymatic activity of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-6-(2-Amino-2-(3-(2-(4-Methylpyridin-2-Yl) Ethyl)Phenyl)Ethyl)-4-Methylpyridin-2-Amine

All present enzymatic activity of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-6-(2-Amino-2-(3-(2-(4-Methylpyridin-2-Yl) Ethyl)Phenyl)Ethyl)-4-Methylpyridin-2-Amine:
1.14.13.39;

Protein crystallography data

The structure of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-6-(2-Amino-2-(3-(2-(4-Methylpyridin-2-Yl) Ethyl)Phenyl)Ethyl)-4-Methylpyridin-2-Amine, PDB code: 4ctz was solved by G.Chreifi, H.Li, T.L.Poulos, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 48.58 / 2.01
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 58.032, 106.697, 158.400, 90.00, 90.00, 90.00
R / Rfree (%) 16.461 / 20.54

Other elements in 4ctz:

The structure of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-6-(2-Amino-2-(3-(2-(4-Methylpyridin-2-Yl) Ethyl)Phenyl)Ethyl)-4-Methylpyridin-2-Amine also contains other interesting chemical elements:

Arsenic (As) 2 atoms
Iron (Fe) 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 (S)-6-(2-Amino-2-(3-(2-(4-Methylpyridin-2-Yl) Ethyl)Phenyl)Ethyl)-4-Methylpyridin-2-Amine (pdb code 4ctz). 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 (S)-6-(2-Amino-2-(3-(2-(4-Methylpyridin-2-Yl) Ethyl)Phenyl)Ethyl)-4-Methylpyridin-2-Amine, PDB code: 4ctz:

Zinc binding site 1 out of 1 in 4ctz

Go back to Zinc Binding Sites List in 4ctz
Zinc binding site 1 out of 1 in the Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-6-(2-Amino-2-(3-(2-(4-Methylpyridin-2-Yl) Ethyl)Phenyl)Ethyl)-4-Methylpyridin-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 (S)-6-(2-Amino-2-(3-(2-(4-Methylpyridin-2-Yl) Ethyl)Phenyl)Ethyl)-4-Methylpyridin-2-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn900

b:91.1
occ:1.00
 SG B:CYS96 2.6 88.9 1.0
SG A:CYS96 2.7 84.0 1.0
SG B:CYS101 2.7 82.2 1.0
SG A:CYS101 2.7 80.7 1.0
CB B:CYS101 3.3 83.1 1.0
CB B:CYS96 3.4 83.8 1.0
CB A:CYS101 3.5 74.0 1.0
CB A:CYS96 3.6 93.5 1.0
CA B:CYS101 3.6 85.1 1.0
CA A:CYS101 3.8 84.6 1.0
N B:GLY103 4.0 85.6 1.0
N B:LEU102 4.0 89.1 1.0
N A:LEU102 4.1 90.3 1.0
C B:CYS101 4.2 88.8 1.0
N A:GLY103 4.3 81.6 1.0
C A:CYS101 4.4 87.9 1.0
CA B:GLY103 4.4 81.5 1.0
CA A:GLY103 4.7 85.1 1.0
C B:LEU102 4.9 88.4 1.0
N B:CYS101 4.9 80.0 1.0
CA B:CYS96 4.9 88.3 1.0
C A:LEU102 5.0 90.0 1.0

Reference:

S.Kang, W.Tang, H.Li, G.Chreifi, P.Martasek, L.J.Roman, T.L.Poulos, R.B.Silverman. Nitric Oxide Synthase Inhibitors That Interact with Both A Heme Propionate and Tetrahydrobiopterin Show High Isoform Selectivity. J.Med.Chem. V. 57 4382 2014.
ISSN: ISSN 0022-2623
PubMed: 24758147
DOI: 10.1021/JM5004182
Page generated: Sat Oct 26 21:05:49 2024

Last articles

Mn in 2CYF
Mn in 2D0C
Mn in 2CY6
Mn in 2CWM
Mn in 2CTV
Mn in 2CM1
Mn in 2CPO
Mn in 2CNA
Mn in 2CJ2
Mn in 2CJ1
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy