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Zinc in PDB 4q0l: Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
Enzymatic activity of Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
All present enzymatic activity of Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor:
4.2.1.1;
4.2.1.1;
Protein crystallography data
The structure of Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor, PDB code: 4q0l
was solved by
A.Smirnov,
E.Manakova,
S.Grazulis,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 22.09 / 2.00 |
| Space group | P 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 46.520, 75.211, 77.888, 109.42, 101.60, 107.95 |
| R / Rfree (%) | 26.4 / 32.8 |
Other elements in 4q0l:
The structure of Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor also contains other interesting chemical elements:
| Fluorine | (F) | 15 atoms |
Zinc Binding Sites:
The binding sites of Zinc atom in the Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
(pdb code 4q0l). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 4 binding sites of Zinc where determined in the Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor, PDB code: 4q0l:
Jump to Zinc binding site number: 1; 2; 3; 4;
In total 4 binding sites of Zinc where determined in the Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor, PDB code: 4q0l:
Jump to Zinc binding site number: 1; 2; 3; 4;
Zinc binding site 1 out of 4 in 4q0l
Go back to
Zinc Binding Sites List in 4q0l
Zinc binding site 1 out
of 4 in the Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
Mono view
Stereo pair view
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 Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor within 5.0Å range:
|
Zinc binding site 2 out of 4 in 4q0l
Go back to
Zinc Binding Sites List in 4q0l
Zinc binding site 2 out
of 4 in the Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
Mono view
Stereo pair view
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 Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor within 5.0Å range:
|
Zinc binding site 3 out of 4 in 4q0l
Go back to
Zinc Binding Sites List in 4q0l
Zinc binding site 3 out
of 4 in the Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor within 5.0Å range:
|
Zinc binding site 4 out of 4 in 4q0l
Go back to
Zinc Binding Sites List in 4q0l
Zinc binding site 4 out
of 4 in the Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor within 5.0Å range:
|
Reference:
V.Dudutiene,
J.Matuliene,
A.Smirnov,
D.D.Timm,
A.Zubriene,
L.Baranauskiene,
V.Morkunaite,
J.Smirnoviene,
V.Michailoviene,
V.Juozapaitiene,
A.Mickeviciute,
J.Kazokaite,
S.Baksyte,
A.Kasiliauskaite,
J.Jachno,
J.Revuckiene,
M.Kisonaite,
V.Pilipuityte,
E.Ivanauskaite,
G.Milinaviciute,
V.Smirnovas,
V.Petrikaite,
V.Kairys,
V.Petrauskas,
P.Norvaisas,
D.Linge,
P.Gibieza,
E.Capkauskaite,
A.Zaksauskas,
E.Kazlauskas,
E.Manakova,
S.Grazulis,
J.E.Ladbury,
D.Matulis.
Discovery and Characterization of Novel Selective Inhibitors of Carbonic Anhydrase IX. J.Med.Chem. V. 57 9435 2014.
ISSN: ISSN 0022-2623
PubMed: 25358084
DOI: 10.1021/JM501003K
Page generated: Sun Oct 27 06:13:04 2024
ISSN: ISSN 0022-2623
PubMed: 25358084
DOI: 10.1021/JM501003K
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