Atomistry » Zinc » PDB 6sd7-6siy » 6sdl
Atomistry »
  Zinc »
    PDB 6sd7-6siy »
      6sdl »

Zinc in PDB 6sdl: Human Carbonic Anhydrase II in Complex with (R)-N-(3-(1H-Indol-1-Yl)- 2-Methylpropyl)-4-Sulfamoylbenzamide

Enzymatic activity of Human Carbonic Anhydrase II in Complex with (R)-N-(3-(1H-Indol-1-Yl)- 2-Methylpropyl)-4-Sulfamoylbenzamide

All present enzymatic activity of Human Carbonic Anhydrase II in Complex with (R)-N-(3-(1H-Indol-1-Yl)- 2-Methylpropyl)-4-Sulfamoylbenzamide:
4.2.1.1;

Protein crystallography data

The structure of Human Carbonic Anhydrase II in Complex with (R)-N-(3-(1H-Indol-1-Yl)- 2-Methylpropyl)-4-Sulfamoylbenzamide, PDB code: 6sdl was solved by S.Gloeckner, H.D.Gerber, A.Heine, G.Klebe, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 39.94 / 1.08
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 42.323, 41.696, 72.103, 90.00, 104.32, 90.00
R / Rfree (%) 13.6 / 15.4

Other elements in 6sdl:

The structure of Human Carbonic Anhydrase II in Complex with (R)-N-(3-(1H-Indol-1-Yl)- 2-Methylpropyl)-4-Sulfamoylbenzamide also contains other interesting chemical elements:

Mercury (Hg) 2 atoms
Sodium (Na) 1 atom

Zinc Binding Sites:

The binding sites of Zinc atom in the Human Carbonic Anhydrase II in Complex with (R)-N-(3-(1H-Indol-1-Yl)- 2-Methylpropyl)-4-Sulfamoylbenzamide (pdb code 6sdl). 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 Human Carbonic Anhydrase II in Complex with (R)-N-(3-(1H-Indol-1-Yl)- 2-Methylpropyl)-4-Sulfamoylbenzamide, PDB code: 6sdl:

Zinc binding site 1 out of 1 in 6sdl

Go back to Zinc Binding Sites List in 6sdl
Zinc binding site 1 out of 1 in the Human Carbonic Anhydrase II in Complex with (R)-N-(3-(1H-Indol-1-Yl)- 2-Methylpropyl)-4-Sulfamoylbenzamide


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Human Carbonic Anhydrase II in Complex with (R)-N-(3-(1H-Indol-1-Yl)- 2-Methylpropyl)-4-Sulfamoylbenzamide within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn301

b:6.7
occ:1.00
 NP6 A:SBR306 1.9 7.2 1.0
NE2 A:HIS94 2.0 7.1 1.0
ND1 A:HIS119 2.0 6.6 1.0
NE2 A:HIS96 2.1 7.0 1.0
CE1 A:HIS119 2.9 6.4 1.0
O14 A:SBR306 3.0 7.7 1.0
CD2 A:HIS94 3.0 6.8 1.0
CE1 A:HIS94 3.0 7.0 1.0
CD2 A:HIS96 3.0 6.9 1.0
S13 A:SBR306 3.0 7.5 1.0
HE1 A:HIS119 3.1 7.7 1.0
CE1 A:HIS96 3.1 7.6 1.0
CG A:HIS119 3.1 5.8 1.0
HD2 A:HIS94 3.2 8.2 1.0
HD2 A:HIS96 3.2 8.3 1.0
HB2 A:HIS119 3.2 8.0 1.0
HE1 A:HIS94 3.2 8.5 1.0
HE1 A:HIS96 3.3 9.2 1.0
HG1 A:THR199 3.5 8.5 1.0
CB A:HIS119 3.6 6.6 1.0
O A:HOH545 3.7 12.6 1.0
HB3 A:HIS119 3.7 8.0 1.0
OG1 A:THR199 3.9 7.1 1.0
OE1 A:GLU106 4.0 7.0 1.0
O15 A:SBR306 4.1 7.9 1.0
NE2 A:HIS119 4.1 6.7 1.0
ND1 A:HIS94 4.1 7.2 1.0
CG A:HIS94 4.1 7.2 1.0
ND1 A:HIS96 4.2 8.2 1.0
CG A:HIS96 4.2 7.1 1.0
C10 A:SBR306 4.2 8.7 1.0
CD2 A:HIS119 4.2 6.4 1.0
HH2 A:TRP209 4.2 9.4 1.0
O A:HOH475 4.8 25.2 1.0
HE2 A:HIS119 4.8 8.1 1.0
C09 A:SBR306 4.8 9.7 1.0
HD1 A:HIS94 4.9 8.6 1.0
CD A:GLU106 4.9 7.4 1.0
HD1 A:HIS96 4.9 9.9 1.0
C11 A:SBR306 4.9 9.1 1.0
HG11 A:VAL143 4.9 9.5 1.0

Reference:

S.Gloeckner, H.D.Gerber, A.Heine, G.Klebe. Human Carbonic Anhydrase II in Complex with (R)-N-(3-(1H-Indol-1-Yl)-2-Methylpropyl) -4-Sulfamoylbenzamide To Be Published.
Page generated: Tue Oct 29 07:18:19 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