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Fluorine in PDB 3oy3: Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589
Enzymatic activity of Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589
All present enzymatic activity of Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589:
2.7.10.2;
2.7.10.2;
Protein crystallography data
The structure of Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589, PDB code: 3oy3
was solved by
T.Zhou,
L.Commodore,
W.S.Huang,
Y.Wang,
M.Thomas,
J.Keats,
Q.Xu,
V.Rivera,
W.C.Shakespeare,
T.Clackson,
D.C.Dalgarno,
X.Zhu,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 50.00 / 1.95 |
| Space group | P 1 21 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 66.471, 59.988, 89.439, 90.00, 97.97, 90.00 |
| R / Rfree (%) | 22 / 26.6 |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589
(pdb code 3oy3). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 6 binding sites of Fluorine where determined in the Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589, PDB code: 3oy3:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6;
In total 6 binding sites of Fluorine where determined in the Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589, PDB code: 3oy3:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6;
Fluorine binding site 1 out of 6 in 3oy3
Go back to
Fluorine Binding Sites List in 3oy3
Fluorine binding site 1 out
of 6 in the Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589
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 Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589 within 5.0Å range:
|
Fluorine binding site 2 out of 6 in 3oy3
Go back to
Fluorine Binding Sites List in 3oy3
Fluorine binding site 2 out
of 6 in the Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589
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 Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589 within 5.0Å range:
|
Fluorine binding site 3 out of 6 in 3oy3
Go back to
Fluorine Binding Sites List in 3oy3
Fluorine binding site 3 out
of 6 in the Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589
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 Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589 within 5.0Å range:
|
Fluorine binding site 4 out of 6 in 3oy3
Go back to
Fluorine Binding Sites List in 3oy3
Fluorine binding site 4 out
of 6 in the Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589
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 4 of Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589 within 5.0Å range:
|
Fluorine binding site 5 out of 6 in 3oy3
Go back to
Fluorine Binding Sites List in 3oy3
Fluorine binding site 5 out
of 6 in the Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589
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 5 of Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589 within 5.0Å range:
|
Fluorine binding site 6 out of 6 in 3oy3
Go back to
Fluorine Binding Sites List in 3oy3
Fluorine binding site 6 out
of 6 in the Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589
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 6 of Crystal Structure of Abl T315I Mutant Kinase Domain Bound with A Dfg- Out Inhibitor AP24589 within 5.0Å range:
|
Reference:
T.Zhou,
L.Commodore,
W.S.Huang,
Y.Wang,
M.Thomas,
J.Keats,
Q.Xu,
V.M.Rivera,
W.C.Shakespeare,
T.Clackson,
D.C.Dalgarno,
X.Zhu.
Structural Mechanism of the Pan-Bcr-Abl Inhibitor Ponatinib (AP24534): Lessons For Overcoming Kinase Inhibitor Resistance. Chem.Biol.Drug Des. V. 77 1 2011.
ISSN: ISSN 1747-0277
PubMed: 21118377
DOI: 10.1111/J.1747-0285.2010.01054.X
Page generated: Sun Dec 13 11:52:42 2020
ISSN: ISSN 1747-0277
PubMed: 21118377
DOI: 10.1111/J.1747-0285.2010.01054.X
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