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:	Putative dipeptidase
ID:	Q93J45_STRCO
AC:	Q93J45
Organism:	Streptomyces coelicolor / M145)
Reign:	Bacteria
TaxID:	100226
EC Number:	/

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Chains:

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

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Ligand binding site composition:

B-Factor:	23.350
Number of residues:	25
Including
Standard Amino Acids:	21
Non Standard Amino Acids:	2
Water Molecules:	2
Cofactors:
Metals:	ZN ZN

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Cavity properties

Ligandability	Volume (Å3)
0.803	1042.875

% Hydrophobic	% Polar
32.04	67.96
According to VolSite

HET Code:	B88
Formula:	C7H12NO6P
Molecular weight:	237.147 g/mol
DrugBank ID:	-
Buried Surface Area:	66.99 %
Polar Surface area:	157.84 Å2

Number of
H-Bond Acceptors:	6
H-Bond Donors:	1
Rings:	0
Aromatic rings:	0
Anionic atoms:	3
Cationic atoms:	1
Rule of Five Violation:	0
Rotatable Bonds:	6

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Mass center Coordinates

X	Y	Z
-12.9814	38.4923	-4.17053

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