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:	Adenylate cyclase type 2	Adenylate cyclase type 5
ID:	ADCY2_RAT	ADCY5_CANLF
AC:	P26769	P30803
Organism:	Rattus norvegicus	Canis lupus familiaris
Reign:	Eukaryota
TaxID:	10116	9615
EC Number:	/

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Chains:

Chain Name:	Percentage of Residues within binding site
A	59 %
B	41 %

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Ligand binding site composition:

B-Factor:	24.393
Number of residues:	31
Including
Standard Amino Acids:	28
Non Standard Amino Acids:	2
Water Molecules:	1
Cofactors:
Metals:	CA

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Cavity properties

Ligandability	Volume (Å3)
0.982	570.375

% Hydrophobic	% Polar
45.56	54.44
According to VolSite

HET Code:	FKP
Formula:	C30H51N2O7
Molecular weight:	551.735 g/mol
DrugBank ID:	-
Buried Surface Area:	53.95 %
Polar Surface area:	120.97 Å2

Number of
H-Bond Acceptors:	8
H-Bond Donors:	4
Rings:	4
Aromatic rings:	0
Anionic atoms:	0
Cationic atoms:	1
Rule of Five Violation:	1
Rotatable Bonds:	8

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Mass center Coordinates

X	Y	Z
14.0836	10.3254	15.0027

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