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:	Xaa-Pro dipeptidase
ID:	PEPQ_ALTSX
AC:	Q44238
Organism:	Alteromonas sp
Reign:	Bacteria
TaxID:	232
EC Number:	3.4.13.9

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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:	29.038
Number of residues:	21
Including
Standard Amino Acids:	19
Non Standard Amino Acids:	2
Water Molecules:	0
Cofactors:
Metals:	MN MN

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Cavity properties

Ligandability	Volume (Å3)
0.293	418.500

% Hydrophobic	% Polar
45.16	54.84
According to VolSite

HET Code:	M44
Formula:	C6H16N2O2P
Molecular weight:	179.177 g/mol
DrugBank ID:	-
Buried Surface Area:	59.69 %
Polar Surface area:	74 Å2

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

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Mass center Coordinates

X	Y	Z
32.393	72.7889	34.2521

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