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:	Pol protein
ID:	Q000H7_9HIV1
AC:	Q000H7
Organism:	Human immunodeficiency virus 1
Reign:	Viruses
TaxID:	11676
EC Number:	/

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Chains:

Chain Name:	Percentage of Residues within binding site
A	44 %
B	56 %

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Ligand binding site composition:

B-Factor:	22.339
Number of residues:	36
Including
Standard Amino Acids:	34
Non Standard Amino Acids:	0
Water Molecules:	2
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
0.295	384.750

% Hydrophobic	% Polar
39.47	60.53
According to VolSite

HET Code:	RSZ
Formula:	C34H39N5O5
Molecular weight:	597.704 g/mol
DrugBank ID:	-
Buried Surface Area:	38.66 %
Polar Surface area:	149.51 Å2

Number of
H-Bond Acceptors:	6
H-Bond Donors:	5
Rings:	3
Aromatic rings:	3
Anionic atoms:	0
Cationic atoms:	0
Rule of Five Violation:	1
Rotatable Bonds:	15

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Mass center Coordinates

X	Y	Z
14.1238	9.32434	-0.0489773

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