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:	Class 10 plant pathogenesis-related protein
ID:	Q9LLQ2_LUPLU
AC:	Q9LLQ2
Organism:	Lupinus luteus
Reign:	Eukaryota
TaxID:	3873
EC Number:	/

---

Chains:

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

---

Ligand binding site composition:

B-Factor:	18.473
Number of residues:	24
Including
Standard Amino Acids:	21
Non Standard Amino Acids:	2
Water Molecules:	1
Cofactors:
Metals:

---

Cavity properties

Ligandability	Volume (Å3)
1.155	1495.125

% Hydrophobic	% Polar
56.21	43.79
According to VolSite

HET Code:	ZEA
Formula:	C10H13N5O
Molecular weight:	219.243 g/mol
DrugBank ID:	DB11337
Buried Surface Area:	53.72 %
Polar Surface area:	86.72 Å2

Number of
H-Bond Acceptors:	5
H-Bond Donors:	3
Rings:	2
Aromatic rings:	2
Anionic atoms:	0
Cationic atoms:	0
Rule of Five Violation:	0
Rotatable Bonds:	4

---

Mass center Coordinates

X	Y	Z
60.5791	44.0174	4.564

• 2D View
• 3D View