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:	Streptogramin A acetyltransferase
ID:	VATD_ENTFC
AC:	P50870
Organism:	Enterococcus faecium
Reign:	Bacteria
TaxID:	1352
EC Number:	2.3.1

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Chains:

Chain Name:	Percentage of Residues within binding site
D	41 %
E	59 %

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Ligand binding site composition:

B-Factor:	22.571
Number of residues:	30
Including
Standard Amino Acids:	28
Non Standard Amino Acids:	1
Water Molecules:	1
Cofactors:	COA
Metals:

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Cavity properties

Ligandability	Volume (Å3)
1.117	654.750

% Hydrophobic	% Polar
50.00	50.00
According to VolSite

HET Code:	VIR
Formula:	C28H35N3O7
Molecular weight:	525.593 g/mol
DrugBank ID:	DB01669
Buried Surface Area:	47.2 %
Polar Surface area:	139.04 Å2

Number of
H-Bond Acceptors:	7
H-Bond Donors:	2
Rings:	3
Aromatic rings:	1
Anionic atoms:	0
Cationic atoms:	0
Rule of Five Violation:	1
Rotatable Bonds:	1

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Mass center Coordinates

X	Y	Z
-7.49368	-40.0861	-27.633

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