Atomistry » Zinc » PDB 6eom-6ezf » 6equ
Atomistry »
  Zinc »
    PDB 6eom-6ezf »
      6equ »

Zinc in PDB 6equ: X-Ray Crystal Structure of the Human Carbonic Anhydrase II Adduct with A Membrane-Impermeant Inhibitor

Enzymatic activity of X-Ray Crystal Structure of the Human Carbonic Anhydrase II Adduct with A Membrane-Impermeant Inhibitor

All present enzymatic activity of X-Ray Crystal Structure of the Human Carbonic Anhydrase II Adduct with A Membrane-Impermeant Inhibitor:
4.2.1.1;

Protein crystallography data

The structure of X-Ray Crystal Structure of the Human Carbonic Anhydrase II Adduct with A Membrane-Impermeant Inhibitor, PDB code: 6equ was solved by V.Alterio, G.De Simone, D.Esposito, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 25.30 / 1.65
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 42.141, 41.259, 71.922, 90.00, 104.17, 90.00
R / Rfree (%) 17.5 / 21

Zinc Binding Sites:

The binding sites of Zinc atom in the X-Ray Crystal Structure of the Human Carbonic Anhydrase II Adduct with A Membrane-Impermeant Inhibitor (pdb code 6equ). 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 X-Ray Crystal Structure of the Human Carbonic Anhydrase II Adduct with A Membrane-Impermeant Inhibitor, PDB code: 6equ:

Zinc binding site 1 out of 1 in 6equ

Go back to Zinc Binding Sites List in 6equ
Zinc binding site 1 out of 1 in the X-Ray Crystal Structure of the Human Carbonic Anhydrase II Adduct with A Membrane-Impermeant Inhibitor


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of X-Ray Crystal Structure of the Human Carbonic Anhydrase II Adduct with A Membrane-Impermeant Inhibitor within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn301

b:8.6
occ:1.00
 N2 A:BVE302 2.0 8.3 1.0
NE2 A:HIS96 2.0 6.8 1.0
NE2 A:HIS94 2.0 5.7 1.0
ND1 A:HIS119 2.1 6.8 1.0
CE1 A:HIS119 2.9 5.6 1.0
O1 A:BVE302 3.0 7.6 1.0
CD2 A:HIS96 3.0 6.8 1.0
CD2 A:HIS94 3.0 7.7 1.0
CE1 A:HIS94 3.0 6.6 1.0
CE1 A:HIS96 3.0 6.0 1.0
S1 A:BVE302 3.1 7.2 1.0
CG A:HIS119 3.2 7.1 1.0
CB A:HIS119 3.6 5.7 1.0
OG1 A:THR199 3.9 5.8 1.0
OE1 A:GLU106 3.9 6.3 1.0
O2 A:BVE302 4.1 7.8 1.0
NE2 A:HIS119 4.1 5.5 1.0
ND1 A:HIS94 4.1 7.5 1.0
ND1 A:HIS96 4.1 5.8 1.0
CG A:HIS96 4.1 7.0 1.0
CG A:HIS94 4.2 5.4 1.0
CD2 A:HIS119 4.2 5.7 1.0
C24 A:BVE302 4.3 8.3 1.0
C16 A:BVE302 4.7 33.9 1.0
C15 A:BVE302 4.9 33.2 1.0
CD A:GLU106 4.9 8.2 1.0
C29 A:BVE302 4.9 9.9 1.0

Reference:

V.Alterio, D.Esposito, S.M.Monti, C.T.Supuran, G.De Simone. Crystal Structure of the Human Carbonic Anhydrase II Adduct with 1-(4-Sulfamoylphenyl-Ethyl)-2,4,6-Triphenylpyridinium Perchlorate, A Membrane-Impermeant, Isoform Selective Inhibitor. J Enzyme Inhib Med Chem V. 33 151 2018.
ISSN: ESSN 1475-6374
PubMed: 29199489
DOI: 10.1080/14756366.2017.1405263
Page generated: Mon Oct 28 20:19:31 2024

Last articles

Zn in 9JPJ
Zn in 9JP7
Zn in 9JPK
Zn in 9JPL
Zn in 9GN6
Zn in 9GN7
Zn in 9GKU
Zn in 9GKW
Zn in 9GKX
Zn in 9GL0
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy