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:	36.898
Number of residues:	32
Including
Standard Amino Acids:	30
Non Standard Amino Acids:	2
Water Molecules:	0
Cofactors:
Metals:	MN MN

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Cavity properties

Ligandability	Volume (Å3)
0.421	718.875

% Hydrophobic	% Polar
41.31	58.69
According to VolSite

HET Code:	KDH
Formula:	C22H18O11
Molecular weight:	458.372 g/mol
DrugBank ID:	DB12116
Buried Surface Area:	53.65 %
Polar Surface area:	197.36 Å2

Number of
H-Bond Acceptors:	11
H-Bond Donors:	8
Rings:	4
Aromatic rings:	3
Anionic atoms:	0
Cationic atoms:	0
Rule of Five Violation:	2
Rotatable Bonds:	4

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Mass center Coordinates

X	Y	Z
9.80676	-33.81	19.8652

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