Atomistry » Iodine » PDB 3ru1-3unh » 3sd0
Atomistry »
  Iodine »
    PDB 3ru1-3unh »
      3sd0 »

Iodine in PDB 3sd0: Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice

Enzymatic activity of Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice

All present enzymatic activity of Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice:
2.7.11.26;

Protein crystallography data

The structure of Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice, PDB code: 3sd0 was solved by A.M.Mesecar, R.L.Walters, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 44.95 / 2.70
Space group P 21 2 21
Cell size a, b, c (Å), α, β, γ (°) 88.505, 96.010, 124.249, 90.00, 90.00, 90.00
R / Rfree (%) 17.9 / 25.4

Other elements in 3sd0:

The structure of Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice also contains other interesting chemical elements:

Fluorine (F) 2 atoms

Iodine Binding Sites:

The binding sites of Iodine atom in the Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice (pdb code 3sd0). This binding sites where shown within 5.0 Angstroms radius around Iodine atom.
In total 2 binding sites of Iodine where determined in the Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice, PDB code: 3sd0:
Jump to Iodine binding site number: 1; 2;

Iodine binding site 1 out of 2 in 3sd0

Go back to Iodine Binding Sites List in 3sd0
Iodine binding site 1 out of 2 in the Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice


Mono view


Stereo pair view

A full contact list of Iodine with other atoms in the I binding site number 1 of Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice within 5.0Å range:
probe atom residue distance (Å) B Occ
A:I400

b:89.9
occ:1.00
 I31 A:TSK400 0.0 89.9 1.0
C24 A:TSK400 2.1 79.2 1.0
C23 A:TSK400 3.0 77.8 1.0
C25 A:TSK400 3.0 77.9 1.0
O A:ILE62 3.1 60.8 1.0
F30 A:TSK400 3.1 76.0 1.0
CA A:GLY63 3.9 61.5 1.0
O A:HOH455 4.0 59.2 1.0
C A:ILE62 4.1 59.1 1.0
O A:HOH6 4.2 44.4 1.0
C16 A:TSK400 4.3 79.0 1.0
C22 A:TSK400 4.3 79.1 1.0
N A:GLY63 4.4 59.2 1.0
C17 A:TSK400 4.7 79.1 1.0
CG1 A:ILE62 5.0 54.0 1.0

Iodine binding site 2 out of 2 in 3sd0

Go back to Iodine Binding Sites List in 3sd0
Iodine binding site 2 out of 2 in the Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice


Mono view


Stereo pair view

A full contact list of Iodine with other atoms in the I binding site number 2 of Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice within 5.0Å range:
probe atom residue distance (Å) B Occ
B:I400

b:94.5
occ:1.00
 I31 B:TSK400 0.0 94.5 1.0
C24 B:TSK400 2.1 86.3 1.0
C25 B:TSK400 3.0 85.7 1.0
C23 B:TSK400 3.0 85.3 1.0
F30 B:TSK400 3.2 84.8 1.0
O B:ILE62 3.3 79.5 1.0
CA B:GLY63 3.8 75.7 1.0
O B:HOH21 4.0 51.0 1.0
C B:ILE62 4.2 77.5 1.0
C16 B:TSK400 4.2 86.3 1.0
C22 B:TSK400 4.3 86.5 1.0
N B:GLY63 4.4 75.7 1.0
C17 B:TSK400 4.7 86.2 1.0

Reference:

A.M.Mesecar, R.L.Walters. Identification of A Glycogen Synthase Kinase-3B Inhibitor That Attenuates Hyperactivity in Clock Mutant Mice To Be Published.
Page generated: Sun Aug 11 16:39:55 2024

Last articles

Ca in 5N6N
Ca in 5N5K
Ca in 5N5W
Ca in 5N5J
Ca in 5N4L
Ca in 5N3Y
Ca in 5N31
Ca in 5N3V
Ca in 5N34
Ca in 5N2Z
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy