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Chlorine in PDB 6i0j: Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor
Enzymatic activity of Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor
All present enzymatic activity of Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor:
4.2.1.1;
4.2.1.1;
Protein crystallography data
The structure of Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor, PDB code: 6i0j
was solved by
M.Ferraroni,
C.T.Supuran,
M.Bozdag,
D.Chiapponi,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 28.60 / 1.35 |
| Space group | P 21 21 21 |
| Cell size a, b, c (Å), α, β, γ (°) | 62.450, 71.255, 120.999, 90.00, 90.00, 90.00 |
| R / Rfree (%) | 19.7 / 23.3 |
Other elements in 6i0j:
The structure of Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor also contains other interesting chemical elements:
| Fluorine | (F) | 6 atoms |
| Zinc | (Zn) | 2 atoms |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor
(pdb code 6i0j). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor, PDB code: 6i0j:
Jump to Chlorine binding site number: 1; 2;
In total 2 binding sites of Chlorine where determined in the Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor, PDB code: 6i0j:
Jump to Chlorine binding site number: 1; 2;
Chlorine binding site 1 out of 2 in 6i0j
Go back to
Chlorine Binding Sites List in 6i0j
Chlorine binding site 1 out
of 2 in the Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor
Mono view
Stereo pair view
Mono view
Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor within 5.0Å range:
|
Chlorine binding site 2 out of 2 in 6i0j
Go back to
Chlorine Binding Sites List in 6i0j
Chlorine binding site 2 out
of 2 in the Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor
Mono view
Stereo pair view
Mono view
Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Crystal Structure of Human Carbonic Anhydrase I in Complex with the 4- ({[4-Chloro-3-(Trifluoromethyl)Phenyl]Carbamoyl}Amino)Phenyl Sulfamate Inhibitor within 5.0Å range:
|
Reference:
M.Ferraroni,
C.T.Supuran,
M.Bozdag,
D.Chiapponi.
New Classes of Carbonic Anhydrase Inhibitors To Be Published.
Page generated: Sun Jul 28 01:28:54 2024
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