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:	DNA-directed RNA polymerase subunit beta	DNA-directed RNA polymerase subunit beta'
ID:	RPOB_THET8	RPOC_THET8
AC:	Q8RQE9	Q8RQE8
Organism:	Thermus thermophilus
Reign:	Bacteria
TaxID:	300852
EC Number:	/

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Chains:

Chain Name:	Percentage of Residues within binding site
M	37 %
N	63 %

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Ligand binding site composition:

B-Factor:	62.119
Number of residues:	43
Including
Standard Amino Acids:	43
Non Standard Amino Acids:	0
Water Molecules:	0
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
1.703	985.500

% Hydrophobic	% Polar
63.01	36.99
According to VolSite

HET Code:	NE6
Formula:	C23H31NO6
Molecular weight:	417.495 g/mol
DrugBank ID:	DB08266
Buried Surface Area:	55.24 %
Polar Surface area:	99.1 Å2

Number of
H-Bond Acceptors:	7
H-Bond Donors:	0
Rings:	1
Aromatic rings:	0
Anionic atoms:	0
Cationic atoms:	0
Rule of Five Violation:	1
Rotatable Bonds:	11

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Mass center Coordinates

X	Y	Z
163.449	-29.3677	46.307

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