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:	Tricorn protease-interacting factor F3
ID:	TRF3_THEAC
AC:	O93655
Organism:	Thermoplasma acidophilum
Reign:	Archaea
TaxID:	273075
EC Number:	3.4.11

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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:	45.789
Number of residues:	41
Including
Standard Amino Acids:	40
Non Standard Amino Acids:	1
Water Molecules:	0
Cofactors:
Metals:	ZN

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Cavity properties

Ligandability	Volume (Å3)
0.440	789.750

% Hydrophobic	% Polar
41.03	58.97
According to VolSite

HET Code:	FBO
Formula:	C23H31N4O5
Molecular weight:	443.516 g/mol
DrugBank ID:	-
Buried Surface Area:	55.45 %
Polar Surface area:	144.39 Å2

Number of
H-Bond Acceptors:	5
H-Bond Donors:	5
Rings:	2
Aromatic rings:	2
Anionic atoms:	0
Cationic atoms:	1
Rule of Five Violation:	0
Rotatable Bonds:	13

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Mass center Coordinates

X	Y	Z
35.3311	-69.6002	-37.0038

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