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:	Phospholipase A2 VRV-PL-VIIIa
ID:	D0VX11_9SAUR
AC:	D0VX11
Organism:	Daboia russellii pulchella
Reign:	Eukaryota
TaxID:	97228
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:	25.915
Number of residues:	20
Including
Standard Amino Acids:	19
Non Standard Amino Acids:	0
Water Molecules:	1
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
0.895	290.250

% Hydrophobic	% Polar
67.44	32.56
According to VolSite

HET Code:	PZZ
Formula:	C14H21N2O
Molecular weight:	233.329 g/mol
DrugBank ID:	DB08447
Buried Surface Area:	52.16 %
Polar Surface area:	40.46 Å2

Number of
H-Bond Acceptors:	1
H-Bond Donors:	3
Rings:	2
Aromatic rings:	2
Anionic atoms:	0
Cationic atoms:	1
Rule of Five Violation:	0
Rotatable Bonds:	5

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Mass center Coordinates

X	Y	Z
-21.1877	6.22053	6.02035

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