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:	Biflaviolin synthase CYP158A2
ID:	C1582_STRCO
AC:	Q9FCA6
Organism:	Streptomyces coelicolor / M145)
Reign:	Bacteria
TaxID:	100226
EC Number:	/

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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:	16.855
Number of residues:	24
Including
Standard Amino Acids:	21
Non Standard Amino Acids:	2
Water Molecules:	1
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
1.345	1022.625

% Hydrophobic	% Polar
53.80	46.20
According to VolSite

HET Code:	FLV
Formula:	C10H4O5
Molecular weight:	204.136 g/mol
DrugBank ID:	DB02521
Buried Surface Area:	51.34 %
Polar Surface area:	100.49 Å2

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

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Mass center Coordinates

X	Y	Z
51.9311	70.0277	61.4473

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