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Chlorine in PDB 4cr5: Creating Novel F1 Inhibitors Through Fragment Based Lead Generation and Structure Aided Drug Design
Enzymatic activity of Creating Novel F1 Inhibitors Through Fragment Based Lead Generation and Structure Aided Drug Design
All present enzymatic activity of Creating Novel F1 Inhibitors Through Fragment Based Lead Generation and Structure Aided Drug Design:
3.4.21.27;
3.4.21.27;
Protein crystallography data
The structure of Creating Novel F1 Inhibitors Through Fragment Based Lead Generation and Structure Aided Drug Design, PDB code: 4cr5
was solved by
J.Sandmark,
L.Oster,
O.Fjellstrom,
S.Akkaya,
H.G.Beisel,
P.O.Eriksson,
K.Erixon,
D.Gustafsson,
U.Jurva,
D.Kang,
D.Karis,
W.Knecht,
V.Nerme,
I.Nilsson,
T.Olsson,
A.Redzic,
R.Roth,
A.Tigerstrom,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 24.71 / 2.00 |
| Space group | I 2 3 |
| Cell size a, b, c (Å), α, β, γ (°) | 120.990, 120.990, 120.990, 90.00, 90.00, 90.00 |
| R / Rfree (%) | 20.305 / 24.724 |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Creating Novel F1 Inhibitors Through Fragment Based Lead Generation and Structure Aided Drug Design
(pdb code 4cr5). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Creating Novel F1 Inhibitors Through Fragment Based Lead Generation and Structure Aided Drug Design, PDB code: 4cr5:
In total only one binding site of Chlorine was determined in the Creating Novel F1 Inhibitors Through Fragment Based Lead Generation and Structure Aided Drug Design, PDB code: 4cr5:
Chlorine binding site 1 out of 1 in 4cr5
Go back to
Chlorine Binding Sites List in 4cr5
Chlorine binding site 1 out
of 1 in the Creating Novel F1 Inhibitors Through Fragment Based Lead Generation and Structure Aided Drug Design
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 Creating Novel F1 Inhibitors Through Fragment Based Lead Generation and Structure Aided Drug Design within 5.0Å range:
|
Reference:
O.Fjellstrom,
S.Akkaya,
H.Beisel,
P.Eriksson,
K.Erixon,
D.Gustafsson,
U.Jurva,
D.Kang,
D.Karis,
W.Knecht,
V.Nerme,
I.Nilsson,
T.Olsson,
A.Redzic,
R.Roth,
J.Sandmark,
A.Tigerstrom,
L.Oster.
Creating Novel Activated Factor XI Inhibitors Through Fragment Based Lead Generation and Structure Aided Drug Design. Plos One V. 10 13705 2015.
ISSN: ISSN 1932-6203
PubMed: 25629509
DOI: 10.1371/JOURNAL.PONE.0113705
Page generated: Sun Jul 21 11:31:00 2024
ISSN: ISSN 1932-6203
PubMed: 25629509
DOI: 10.1371/JOURNAL.PONE.0113705
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