Atomistry » Zinc » PDB 4k4t-4k9a » 4k5j
Atomistry »
  Zinc »
    PDB 4k4t-4k9a »
      4k5j »

Zinc in PDB 4k5j: Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-1,3-Bis((2-Amino-4-Methylpyridin-6-Yl)-Methoxy)- Butan-4-Amine

Enzymatic activity of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-1,3-Bis((2-Amino-4-Methylpyridin-6-Yl)-Methoxy)- Butan-4-Amine

All present enzymatic activity of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-1,3-Bis((2-Amino-4-Methylpyridin-6-Yl)-Methoxy)- Butan-4-Amine:
1.14.13.39;

Protein crystallography data

The structure of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-1,3-Bis((2-Amino-4-Methylpyridin-6-Yl)-Methoxy)- Butan-4-Amine, PDB code: 4k5j 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) 46.93 / 2.36
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 57.813, 106.289, 156.720, 90.00, 90.00, 90.00
R / Rfree (%) 16.1 / 21.4

Other elements in 4k5j:

The structure of Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-1,3-Bis((2-Amino-4-Methylpyridin-6-Yl)-Methoxy)- Butan-4-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)-1,3-Bis((2-Amino-4-Methylpyridin-6-Yl)-Methoxy)- Butan-4-Amine (pdb code 4k5j). 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)-1,3-Bis((2-Amino-4-Methylpyridin-6-Yl)-Methoxy)- Butan-4-Amine, PDB code: 4k5j:

Zinc binding site 1 out of 1 in 4k5j

Go back to Zinc Binding Sites List in 4k5j
Zinc binding site 1 out of 1 in the Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with (S)-1,3-Bis((2-Amino-4-Methylpyridin-6-Yl)-Methoxy)- Butan-4-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)-1,3-Bis((2-Amino-4-Methylpyridin-6-Yl)-Methoxy)- Butan-4-Amine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn507

b:63.3
occ:1.00
 SG B:CYS96 2.5 64.0 1.0
SG A:CYS101 2.6 57.0 1.0
SG B:CYS101 2.6 62.8 1.0
SG A:CYS96 2.6 62.8 1.0
CB A:CYS101 3.4 61.2 1.0
CB B:CYS101 3.4 64.7 1.0
CB B:CYS96 3.5 64.9 1.0
CB A:CYS96 3.6 70.3 1.0
CA B:CYS101 3.8 67.7 1.0
CA A:CYS101 3.8 66.6 1.0
N B:GLY103 3.9 65.7 1.0
N B:LEU102 4.0 68.6 1.0
N A:GLY103 4.1 65.3 1.0
C B:CYS101 4.2 68.3 1.0
N A:LEU102 4.3 64.6 1.0
CA B:GLY103 4.4 66.5 1.0
C A:CYS101 4.4 65.0 1.0
CA A:GLY103 4.4 65.2 1.0
C B:LEU102 4.8 66.4 1.0
CA B:CYS96 4.9 68.9 1.0
CA A:CYS96 5.0 75.3 1.0
CA B:LEU102 5.0 65.6 1.0

Reference:

Q.Jing, H.Li, G.Chreifi, L.J.Roman, P.Martasek, T.L.Poulos, R.B.Silverman. Chiral Linkers to Improve Selectivity of Double-Headed Neuronal Nitric Oxide Synthase Inhibitors. Bioorg.Med.Chem.Lett. V. 23 5674 2013.
ISSN: ISSN 0960-894X
PubMed: 23993333
DOI: 10.1016/J.BMCL.2013.08.034
Page generated: Sun Oct 27 01:43:53 2024

Last articles

Mg in 4G0U
Mg in 4G0R
Mg in 4FXF
Mg in 4FYY
Mg in 4G0N
Mg in 4FZL
Mg in 4FYP
Mg in 4FYX
Mg in 4FVA
Mg in 4FVU
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy