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Atomistry » Chlorine » PDB 4tsz-4u2x » 4ty7 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Atomistry » Chlorine » PDB 4tsz-4u2x » 4ty7 » |
Chlorine in PDB 4ty7: Factor Xia in Complex with the Inhibitor (2S)-6-Amino-N-{(1S)-1-[4-(3- Amino-2H-Indazol-6-Yl)-5-Chloro-1H-Imidazol-2-Yl]-2-Phenylethyl}-2- EthylhexanamideEnzymatic activity of Factor Xia in Complex with the Inhibitor (2S)-6-Amino-N-{(1S)-1-[4-(3- Amino-2H-Indazol-6-Yl)-5-Chloro-1H-Imidazol-2-Yl]-2-Phenylethyl}-2- Ethylhexanamide
All present enzymatic activity of Factor Xia in Complex with the Inhibitor (2S)-6-Amino-N-{(1S)-1-[4-(3- Amino-2H-Indazol-6-Yl)-5-Chloro-1H-Imidazol-2-Yl]-2-Phenylethyl}-2- Ethylhexanamide:
3.4.21.27; Protein crystallography data
The structure of Factor Xia in Complex with the Inhibitor (2S)-6-Amino-N-{(1S)-1-[4-(3- Amino-2H-Indazol-6-Yl)-5-Chloro-1H-Imidazol-2-Yl]-2-Phenylethyl}-2- Ethylhexanamide, PDB code: 4ty7
was solved by
A.Wei,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Factor Xia in Complex with the Inhibitor (2S)-6-Amino-N-{(1S)-1-[4-(3- Amino-2H-Indazol-6-Yl)-5-Chloro-1H-Imidazol-2-Yl]-2-Phenylethyl}-2- Ethylhexanamide
(pdb code 4ty7). 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 Factor Xia in Complex with the Inhibitor (2S)-6-Amino-N-{(1S)-1-[4-(3- Amino-2H-Indazol-6-Yl)-5-Chloro-1H-Imidazol-2-Yl]-2-Phenylethyl}-2- Ethylhexanamide, PDB code: 4ty7: Chlorine binding site 1 out of 1 in 4ty7Go back to![]() ![]()
Chlorine binding site 1 out
of 1 in the Factor Xia in Complex with the Inhibitor (2S)-6-Amino-N-{(1S)-1-[4-(3- Amino-2H-Indazol-6-Yl)-5-Chloro-1H-Imidazol-2-Yl]-2-Phenylethyl}-2- Ethylhexanamide
![]() Mono view ![]() Stereo pair view
Reference:
J.Hangeland,
T.J.Friends,
K.A.Rossi,
J.M.Smallheer,
C.Wong,
Z.Sun,
J.R.Corte,
T.Fang,
P.Wong,
A.R.Rendina,
F.Barbera,
J.Bozarth,
J.Luettgen,
C.Watson,
G.Zhang,
A.Wei,
V.Ramamurthy,
P.E.Morin,
G.S.Bisacchi,
D.A.Seiffert,
R.R.Wexler,
M.L.Quan.
Phenylimidazoles As Potent and Selective Inhibitors of Coagulation Factor Xia with in Vivo Antithrombotic Activity. J.Med.Chem. 2014.
Page generated: Fri Jul 26 01:57:05 2024
ISSN: ISSN 0022-2623 PubMed: 25405503 DOI: 10.1021/JM5010607 |
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