Fluorine in PDB 8v72: Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8
Enzymatic activity of Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8
All present enzymatic activity of Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8:
2.7.1.140; 2.7.1.151; 2.7.1.153;
2.7.1.140; 2.7.1.151; 2.7.1.153;
Protein crystallography data
The structure of Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8, PDB code: 8v72
was solved by
H.Wang,
S.B.Shears,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 42.55 / 2.00 |
| Space group | P 42 21 2 |
| Cell size a, b, c (Å), α, β, γ (°) | 77.876, 77.876, 85.037, 90, 90, 90 |
| R / Rfree (%) | 17.2 / 24.3 |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8
(pdb code 8v72). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 3 binding sites of Fluorine where determined in the Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8, PDB code: 8v72:
Jump to Fluorine binding site number: 1; 2; 3;
In total 3 binding sites of Fluorine where determined in the Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8, PDB code: 8v72:
Jump to Fluorine binding site number: 1; 2; 3;
Fluorine binding site 1 out of 3 in 8v72
Go back to
Fluorine Binding Sites List in 8v72
Fluorine binding site 1 out
of 3 in the Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Fluorine with other atoms in the F binding
site number 1 of Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8 within 5.0Å range:
|
Fluorine binding site 2 out of 3 in 8v72
Go back to
Fluorine Binding Sites List in 8v72
Fluorine binding site 2 out
of 3 in the Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Fluorine with other atoms in the F binding
site number 2 of Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8 within 5.0Å range:
|
Fluorine binding site 3 out of 3 in 8v72
Go back to
Fluorine Binding Sites List in 8v72
Fluorine binding site 3 out
of 3 in the Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Fluorine with other atoms in the F binding
site number 3 of Crystal Structure of the Core Catalytic Domain of Human Inositol Phosphate Multikinase in Complex with Compound 8 within 5.0Å range:
|
Reference:
H.Wang,
S.B.Shears.
Structure-Based Development of Ipmk Kinase Inhibitors. To Be Published.
Page generated: Sun Dec 15 10:29:49 2024
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