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:	Pheromone-binding protein ASP1
ID:	Q9U9J6_APIME
AC:	Q9U9J6
Organism:	Apis mellifera
Reign:	Eukaryota
TaxID:	7460
EC Number:	/

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Chains:

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

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Ligand binding site composition:

B-Factor:	20.032
Number of residues:	25
Including
Standard Amino Acids:	23
Non Standard Amino Acids:	1
Water Molecules:	1
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
1.830	766.125

% Hydrophobic	% Polar
71.81	28.19
According to VolSite

HET Code:	9OD
Formula:	C10H15O3
Molecular weight:	183.224 g/mol
DrugBank ID:	-
Buried Surface Area:	61.08 %
Polar Surface area:	57.2 Å2

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

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Mass center Coordinates

X	Y	Z
27.5997	-15.8218	-20.4906

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