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:	Spore photoproduct lyase
ID:	A4IQU1_GEOTN
AC:	A4IQU1
Organism:	Geobacillus thermodenitrificans
Reign:	Bacteria
TaxID:	420246
EC Number:	/

---

Chains:

Chain Name:	Percentage of Residues within binding site
A	100 %

---

Ligand binding site composition:

B-Factor:	40.100
Number of residues:	27
Including
Standard Amino Acids:	26
Non Standard Amino Acids:	1
Water Molecules:	0
Cofactors:
Metals:

---

Cavity properties

Ligandability	Volume (Å3)
1.202	847.125

% Hydrophobic	% Polar
48.21	51.79
According to VolSite

HET Code:	0TT
Formula:	C20H28N4O10
Molecular weight:	484.457 g/mol
DrugBank ID:	-
Buried Surface Area:	57.72 %
Polar Surface area:	198.19 Å2

Number of
H-Bond Acceptors:	10
H-Bond Donors:	6
Rings:	4
Aromatic rings:	0
Anionic atoms:	0
Cationic atoms:	0
Rule of Five Violation:	2
Rotatable Bonds:	6

---

Mass center Coordinates

X	Y	Z
-20.8576	-1.36891	23.5228

• 2D View
• 3D View