Fluorine »
PDB 3uyt-3vrb »
3vc4 »
Fluorine in PDB 3vc4: Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design
Enzymatic activity of Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design
All present enzymatic activity of Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design:
2.7.11.1;
2.7.11.1;
Protein crystallography data
The structure of Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design, PDB code: 3vc4
was solved by
J.Liu,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 85.30 / 2.23 |
| Space group | P 65 |
| Cell size a, b, c (Å), α, β, γ (°) | 98.496, 98.496, 81.025, 90.00, 90.00, 120.00 |
| R / Rfree (%) | 25.7 / 31.9 |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design
(pdb code 3vc4). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 3 binding sites of Fluorine where determined in the Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design, PDB code: 3vc4:
Jump to Fluorine binding site number: 1; 2; 3;
In total 3 binding sites of Fluorine where determined in the Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design, PDB code: 3vc4:
Jump to Fluorine binding site number: 1; 2; 3;
Fluorine binding site 1 out of 3 in 3vc4
Go back to
Fluorine Binding Sites List in 3vc4
Fluorine binding site 1 out
of 3 in the Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design
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 Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design within 5.0Å range:
|
Fluorine binding site 2 out of 3 in 3vc4
Go back to
Fluorine Binding Sites List in 3vc4
Fluorine binding site 2 out
of 3 in the Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design
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 Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design within 5.0Å range:
|
Fluorine binding site 3 out of 3 in 3vc4
Go back to
Fluorine Binding Sites List in 3vc4
Fluorine binding site 3 out
of 3 in the Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design
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 Exploitation of Hydrogen Bonding Constraints and Flat Hydrophobic Energy Landscapes in Pim-1 Kinase Needle Screening and Inhibitor Design within 5.0Å range:
|
Reference:
A.C.Good,
J.Liu,
B.Hirth,
G.Asmussen,
Y.Xiang,
H.P.Biemann,
K.A.Bishop,
T.Fremgen,
M.Fitzgerald,
T.Gladysheva,
A.Jain,
K.Jancsics,
M.Metz,
A.Papoulis,
R.Skerlj,
J.D.Stepp,
R.R.Wei.
Implications of Promiscuous Pim-1 Kinase Fragment Inhibitor Hydrophobic Interactions For Fragment-Based Drug Design. J.Med.Chem. V. 55 2641 2012.
ISSN: ISSN 0022-2623
PubMed: 22339127
DOI: 10.1021/JM2014698
Page generated: Mon Jul 14 19:51:39 2025
ISSN: ISSN 0022-2623
PubMed: 22339127
DOI: 10.1021/JM2014698
Last articles
Mg in 3A7RMg in 3A6P
Mg in 3A7E
Mg in 3A7D
Mg in 3A52
Mg in 3A64
Mg in 3A5T
Mg in 3A58
Mg in 3A5M
Mg in 3A5L
