Calcium in PDB 7ovy: Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain
Enzymatic activity of Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain
All present enzymatic activity of Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain:
3.4.24.65;
3.4.24.65;
Protein crystallography data
The structure of Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain, PDB code: 7ovy
was solved by
L.Ciccone,
A.Rossello,
L.Vera,
E.Nuti,
E.A.Stura,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 48.89 / 1.24 |
| Space group | C 1 2 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 51.34, 60.45, 54.05, 90, 115.24, 90 |
| R / Rfree (%) | 18.4 / 20.9 |
Other elements in 7ovy:
The structure of Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain also contains other interesting chemical elements:
| Zinc | (Zn) | 2 atoms |
| Bromine | (Br) | 4 atoms |
Calcium Binding Sites:
The binding sites of Calcium atom in the Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain
(pdb code 7ovy). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 3 binding sites of Calcium where determined in the Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain, PDB code: 7ovy:
Jump to Calcium binding site number: 1; 2; 3;
In total 3 binding sites of Calcium where determined in the Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain, PDB code: 7ovy:
Jump to Calcium binding site number: 1; 2; 3;
Calcium binding site 1 out of 3 in 7ovy
Go back to
Calcium Binding Sites List in 7ovy
Calcium binding site 1 out
of 3 in the Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain within 5.0Å range:
|
Calcium binding site 2 out of 3 in 7ovy
Go back to
Calcium Binding Sites List in 7ovy
Calcium binding site 2 out
of 3 in the Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain within 5.0Å range:
|
Calcium binding site 3 out of 3 in 7ovy
Go back to
Calcium Binding Sites List in 7ovy
Calcium binding site 3 out
of 3 in the Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Crystal Structure of A Dimeric Based Inhibitor JG34 in Complex with the Mmp-12 Catalytic Domain within 5.0Å range:
|
Reference:
D.Cuffaro,
C.Camodeca,
T.Tuccinardi,
L.Ciccone,
J.W.Bartsch,
T.Kellermann,
L.Cook,
E.Nuti,
A.Rossello.
Discovery of Dimeric Arylsulfonamides As Potent ADAM8 Inhibitors Acs Med.Chem.Lett. 2021.
ISSN: ISSN 1948-5875
DOI: 10.1021/ACSMEDCHEMLETT.1C00411
Page generated: Fri Nov 5 11:40:13 2021
ISSN: ISSN 1948-5875
DOI: 10.1021/ACSMEDCHEMLETT.1C00411
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