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Atomistry » Calcium » PDB 4n66-4nhf » 4nga » |
Calcium in PDB 4nga: Factor Viia in Complex with the Inhibitor (2R)-2-[(1-Aminoisoquinolin- 6-Yl)Amino]-2-[3-Ethoxy-4-(Propan-2-Yloxy)Phenyl]-N-[2-(Propan-2- Ylsulfonyl)Benzyl]EthanamideEnzymatic activity of Factor Viia in Complex with the Inhibitor (2R)-2-[(1-Aminoisoquinolin- 6-Yl)Amino]-2-[3-Ethoxy-4-(Propan-2-Yloxy)Phenyl]-N-[2-(Propan-2- Ylsulfonyl)Benzyl]Ethanamide
All present enzymatic activity of Factor Viia in Complex with the Inhibitor (2R)-2-[(1-Aminoisoquinolin- 6-Yl)Amino]-2-[3-Ethoxy-4-(Propan-2-Yloxy)Phenyl]-N-[2-(Propan-2- Ylsulfonyl)Benzyl]Ethanamide:
3.4.21.21; Protein crystallography data
The structure of Factor Viia in Complex with the Inhibitor (2R)-2-[(1-Aminoisoquinolin- 6-Yl)Amino]-2-[3-Ethoxy-4-(Propan-2-Yloxy)Phenyl]-N-[2-(Propan-2- Ylsulfonyl)Benzyl]Ethanamide, PDB code: 4nga
was solved by
A.Wei,
R.Anumula,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Calcium Binding Sites:
The binding sites of Calcium atom in the Factor Viia in Complex with the Inhibitor (2R)-2-[(1-Aminoisoquinolin- 6-Yl)Amino]-2-[3-Ethoxy-4-(Propan-2-Yloxy)Phenyl]-N-[2-(Propan-2- Ylsulfonyl)Benzyl]Ethanamide
(pdb code 4nga). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total only one binding site of Calcium was determined in the Factor Viia in Complex with the Inhibitor (2R)-2-[(1-Aminoisoquinolin- 6-Yl)Amino]-2-[3-Ethoxy-4-(Propan-2-Yloxy)Phenyl]-N-[2-(Propan-2- Ylsulfonyl)Benzyl]Ethanamide, PDB code: 4nga: Calcium binding site 1 out of 1 in 4ngaGo back to Calcium Binding Sites List in 4nga
Calcium binding site 1 out
of 1 in the Factor Viia in Complex with the Inhibitor (2R)-2-[(1-Aminoisoquinolin- 6-Yl)Amino]-2-[3-Ethoxy-4-(Propan-2-Yloxy)Phenyl]-N-[2-(Propan-2- Ylsulfonyl)Benzyl]Ethanamide
Mono view Stereo pair view
Reference:
X.Zhang,
W.Jiang,
S.Jacutin-Porte,
P.W.Glunz,
Y.Zou,
X.Chen,
A.H.Nirschl,
N.R.Wurtz,
J.M.Luettgen,
A.R.Rendina,
G.Luo,
T.M.Harper,
A.Wei,
R.Anumula,
D.L.Cheney,
R.M.Knabb,
P.C.Wong,
R.R.Wexler,
E.S.Priestley.
Design and Synthesis of Phenylpyrrolidine Phenylglycinamides As Highly Potent and Selective Tf-Fviia Inhibitors Acs Med.Chem.Lett. V. 5 188 2014.
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