Fluorine in PDB 8ex2: Crystal Structure of JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3
Enzymatic activity of Crystal Structure of JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3
All present enzymatic activity of Crystal Structure of JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3:
2.7.10.2;
2.7.10.2;
Protein crystallography data
The structure of Crystal Structure of JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3, PDB code: 8ex2
was solved by
P.Sampathkumar,
S.R.Hubbard,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 27.02 / 1.90 |
| Space group | C 1 2 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 92.169, 57.423, 60.523, 90, 94.55, 90 |
| R / Rfree (%) | 16.9 / 20.3 |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Crystal Structure of JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3
(pdb code 8ex2). 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 JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3, PDB code: 8ex2:
Jump to Fluorine binding site number: 1; 2; 3;
In total 3 binding sites of Fluorine where determined in the Crystal Structure of JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3, PDB code: 8ex2:
Jump to Fluorine binding site number: 1; 2; 3;
Fluorine binding site 1 out of 3 in 8ex2
Go back to
Fluorine Binding Sites List in 8ex2
Fluorine binding site 1 out
of 3 in the Crystal Structure of JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3
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 JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3 within 5.0Å range:
|
Fluorine binding site 2 out of 3 in 8ex2
Go back to
Fluorine Binding Sites List in 8ex2
Fluorine binding site 2 out
of 3 in the Crystal Structure of JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3
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 JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3 within 5.0Å range:
|
Fluorine binding site 3 out of 3 in 8ex2
Go back to
Fluorine Binding Sites List in 8ex2
Fluorine binding site 3 out
of 3 in the Crystal Structure of JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3
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 JAK2 JH2 (Pseudokinase Domain) in Complex with HTSA3 within 5.0Å range:
|
Reference:
A.T.Virtanen,
T.Haikarainen,
P.Sampathkumar,
M.Palmroth,
S.Liukkonen,
J.Liu,
N.Nekhotiaeva,
S.R.Hubbard,
O.Silvennoinen.
Identification of Novel Small Molecule Ligands For JAK2 Pseudokinase Domain. Pharmaceuticals V. 16 2023.
ISSN: ESSN 1424-8247
PubMed: 36678572
DOI: 10.3390/PH16010075
Page generated: Wed Apr 5 02:24:11 2023
ISSN: ESSN 1424-8247
PubMed: 36678572
DOI: 10.3390/PH16010075
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