Atomistry » Zinc » PDB 1rae-1rpj » 1rj6
Atomistry »
  Zinc »
    PDB 1rae-1rpj »
      1rj6 »

Zinc in PDB 1rj6: Crystal Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv in Complex with Acetazolamide

Enzymatic activity of Crystal Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv in Complex with Acetazolamide

All present enzymatic activity of Crystal Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv in Complex with Acetazolamide:
4.2.1.1;

Protein crystallography data

The structure of Crystal Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv in Complex with Acetazolamide, PDB code: 1rj6 was solved by D.A.Whittington, J.H.Grubb, A.Waheed, G.N.Shah, W.S.Sly, D.W.Christianson, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 30.00 / 2.90
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 59.200, 75.800, 73.800, 90.00, 99.20, 90.00
R / Rfree (%) 20.7 / 25.3

Zinc Binding Sites:

The binding sites of Zinc atom in the Crystal Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv in Complex with Acetazolamide (pdb code 1rj6). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 2 binding sites of Zinc where determined in the Crystal Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv in Complex with Acetazolamide, PDB code: 1rj6:
Jump to Zinc binding site number: 1; 2;

Zinc binding site 1 out of 2 in 1rj6

Go back to Zinc Binding Sites List in 1rj6
Zinc binding site 1 out of 2 in the Crystal Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv in Complex with Acetazolamide


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Crystal Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv in Complex with Acetazolamide within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn601

b:68.0
occ:1.00
N1 A:AZM400 2.2 0.8 1.0
NE2 A:HIS96 2.2 49.1 1.0
NE2 A:HIS94 2.3 54.4 1.0
ND1 A:HIS119 2.3 24.3 1.0
CD2 A:HIS94 2.8 54.4 1.0
CD2 A:HIS96 2.9 49.1 1.0
CE1 A:HIS119 3.1 24.3 1.0
CG A:HIS119 3.2 24.3 1.0
CE1 A:HIS96 3.3 49.1 1.0
S1 A:AZM400 3.3 0.8 1.0
O1 A:AZM400 3.4 0.8 1.0
CE1 A:HIS94 3.5 54.4 1.0
CB A:HIS119 3.6 24.3 1.0
OG1 A:THR199 3.9 63.0 1.0
CG A:HIS94 4.0 54.4 1.0
CG A:HIS96 4.2 49.1 1.0
NE2 A:HIS119 4.2 24.3 1.0
OE2 A:GLU106 4.2 33.6 1.0
CD2 A:HIS119 4.2 24.3 1.0
O2 A:AZM400 4.2 0.8 1.0
ND1 A:HIS96 4.3 49.1 1.0
ND1 A:HIS94 4.4 54.4 1.0
C1 A:AZM400 4.6 0.8 1.0
CD A:GLU106 4.9 33.6 1.0

Zinc binding site 2 out of 2 in 1rj6

Go back to Zinc Binding Sites List in 1rj6
Zinc binding site 2 out of 2 in the Crystal Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv in Complex with Acetazolamide


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Crystal Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv in Complex with Acetazolamide within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Zn601

b:59.7
occ:1.00
NE2 B:HIS96 2.0 33.6 1.0
NE2 B:HIS94 2.3 42.1 1.0
N1 B:AZM401 2.4 0.0 1.0
ND1 B:HIS119 2.4 35.3 1.0
CD2 B:HIS94 2.7 42.1 1.0
CD2 B:HIS96 2.8 33.6 1.0
O1 B:AZM401 3.1 0.0 1.0
CE1 B:HIS96 3.2 33.6 1.0
CE1 B:HIS119 3.2 35.3 1.0
CG B:HIS119 3.2 35.3 1.0
S1 B:AZM401 3.3 0.0 1.0
CE1 B:HIS94 3.6 42.1 1.0
CB B:HIS119 3.6 35.3 1.0
OG1 B:THR199 4.0 39.4 1.0
OE2 B:GLU106 4.0 41.4 1.0
CG B:HIS96 4.0 33.6 1.0
CG B:HIS94 4.0 42.1 1.0
ND1 B:HIS96 4.1 33.6 1.0
NE2 B:HIS119 4.2 35.3 1.0
CD2 B:HIS119 4.3 35.3 1.0
O2 B:AZM401 4.3 0.0 1.0
ND1 B:HIS94 4.4 42.1 1.0
C1 B:AZM401 4.5 0.0 1.0
CD B:GLU106 4.7 41.4 1.0
O B:HOH911 4.8 27.8 1.0

Reference:

D.A.Whittington, J.H.Grubb, A.Waheed, G.N.Shah, W.S.Sly, D.W.Christianson. Expression, Assay, and Structure of the Extracellular Domain of Murine Carbonic Anhydrase Xiv: Implications For Selective Inhibition of Membrane-Associated Isozymes. J.Biol.Chem. V. 279 7223 2004.
ISSN: ISSN 0021-9258
PubMed: 14660577
DOI: 10.1074/JBC.M310809200
Page generated: Wed Oct 16 18:35:21 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