sc-PDB

List of CHEMBLId :

This value allows a number of roughly comparable measures of half-maximal response concentration/potency/affinity to be compared on a negative logarithmic scale (e.g., an IC50 measurement of 1nM would have a pChEMBL value of 9).

Uniprot Annotation

Name:	Polymerase acidic protein
ID:	C3W5S0_I09A0
AC:	C3W5S0
Organism:	Influenza A virus
Reign:	Viruses
TaxID:	641501
EC Number:	/

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Chains:

Chain Name:	Percentage of Residues within binding site
A	100 %

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Ligand binding site composition:

B-Factor:	75.787
Number of residues:	23
Including
Standard Amino Acids:	20
Non Standard Amino Acids:	2
Water Molecules:	1
Cofactors:
Metals:	MN MN

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Cavity properties

Ligandability	Volume (Å3)
0.099	357.750

% Hydrophobic	% Polar
50.00	50.00
According to VolSite

HET Code:	0N8
Formula:	C23H24ClNO4
Molecular weight:	413.894 g/mol
DrugBank ID:	-
Buried Surface Area:	45.69 %
Polar Surface area:	81.87 Å2

Number of
H-Bond Acceptors:	4
H-Bond Donors:	2
Rings:	3
Aromatic rings:	2
Anionic atoms:	1
Cationic atoms:	1
Rule of Five Violation:	0
Rotatable Bonds:	7

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Mass center Coordinates

X	Y	Z
2.95323	-58.2485	420.301

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