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:	Bifunctional dethiobiotin synthetase/7,8-diamino-pelargonic acid aminotransferase, mitochondrial
ID:	BIODA_ARATH
AC:	B0F481
Organism:	Arabidopsis thaliana
Reign:	Eukaryota
TaxID:	3702
EC Number:	6.3.3.3

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Chains:

Chain Name:	Percentage of Residues within binding site
A	28 %
B	72 %

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Ligand binding site composition:

B-Factor:	25.334
Number of residues:	36
Including
Standard Amino Acids:	36
Non Standard Amino Acids:	0
Water Molecules:	0
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
0.442	604.125

% Hydrophobic	% Polar
38.55	61.45
According to VolSite

HET Code:	DTB
Formula:	C10H17N2O3
Molecular weight:	213.254 g/mol
DrugBank ID:	DB03775
Buried Surface Area:	67.3 %
Polar Surface area:	81.25 Å2

Number of
H-Bond Acceptors:	3
H-Bond Donors:	2
Rings:	1
Aromatic rings:	0
Anionic atoms:	1
Cationic atoms:	0
Rule of Five Violation:	0
Rotatable Bonds:	6

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Mass center Coordinates

X	Y	Z
-4.0034	12.9784	20.8034

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