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Chlorine in PDB 4wki: Crystal Structure of Human Adamts-4 in Complex with Inhibitor 5- Chloro-N-{[(4S)-4-(1-Methyl-1H-Imidazol-2-Yl)-2,5-Dioxoimidazolidin- 4-Yl]Methyl}-1-Benzofuran-2-Carboxamide (Compound 11)Enzymatic activity of Crystal Structure of Human Adamts-4 in Complex with Inhibitor 5- Chloro-N-{[(4S)-4-(1-Methyl-1H-Imidazol-2-Yl)-2,5-Dioxoimidazolidin- 4-Yl]Methyl}-1-Benzofuran-2-Carboxamide (Compound 11)
All present enzymatic activity of Crystal Structure of Human Adamts-4 in Complex with Inhibitor 5- Chloro-N-{[(4S)-4-(1-Methyl-1H-Imidazol-2-Yl)-2,5-Dioxoimidazolidin- 4-Yl]Methyl}-1-Benzofuran-2-Carboxamide (Compound 11):
3.4.24.82; Protein crystallography data
The structure of Crystal Structure of Human Adamts-4 in Complex with Inhibitor 5- Chloro-N-{[(4S)-4-(1-Methyl-1H-Imidazol-2-Yl)-2,5-Dioxoimidazolidin- 4-Yl]Methyl}-1-Benzofuran-2-Carboxamide (Compound 11), PDB code: 4wki
was solved by
J.D.Durbin,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Other elements in 4wki:
The structure of Crystal Structure of Human Adamts-4 in Complex with Inhibitor 5- Chloro-N-{[(4S)-4-(1-Methyl-1H-Imidazol-2-Yl)-2,5-Dioxoimidazolidin- 4-Yl]Methyl}-1-Benzofuran-2-Carboxamide (Compound 11) also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of Human Adamts-4 in Complex with Inhibitor 5- Chloro-N-{[(4S)-4-(1-Methyl-1H-Imidazol-2-Yl)-2,5-Dioxoimidazolidin- 4-Yl]Methyl}-1-Benzofuran-2-Carboxamide (Compound 11)
(pdb code 4wki). 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 Crystal Structure of Human Adamts-4 in Complex with Inhibitor 5- Chloro-N-{[(4S)-4-(1-Methyl-1H-Imidazol-2-Yl)-2,5-Dioxoimidazolidin- 4-Yl]Methyl}-1-Benzofuran-2-Carboxamide (Compound 11), PDB code: 4wki: Chlorine binding site 1 out of 1 in 4wkiGo back to![]() ![]()
Chlorine binding site 1 out
of 1 in the Crystal Structure of Human Adamts-4 in Complex with Inhibitor 5- Chloro-N-{[(4S)-4-(1-Methyl-1H-Imidazol-2-Yl)-2,5-Dioxoimidazolidin- 4-Yl]Methyl}-1-Benzofuran-2-Carboxamide (Compound 11)
![]() Mono view ![]() Stereo pair view
Reference:
T.B.Durham,
V.J.Klimkowski,
C.J.Rito,
J.Marimuthu,
J.L.Toth,
C.Liu,
J.D.Durbin,
S.L.Stout,
L.Adams,
C.Swearingen,
C.Lin,
M.G.Chambers,
K.Thirunavukkarasu,
M.R.Wiley.
Identification of Potent and Selective Hydantoin Inhibitors of Aggrecanase-1 and Aggrecanase-2 That Are Efficacious in Both Chemical and Surgical Models of Osteoarthritis. J.Med.Chem. 2014.
Page generated: Sat Dec 12 11:18:11 2020
ISSN: ISSN 0022-2623 PubMed: 25415648 DOI: 10.1021/JM501522N |
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