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:	Reaction center protein L chain
ID:	RCEL_BLAVI
AC:	P06009
Organism:	Blastochloris viridis
Reign:	Bacteria
TaxID:	1079
EC Number:	/

---

Chains:

Chain Name:	Percentage of Residues within binding site
L	91 %
M	5 %
H	5 %

---

Ligand binding site composition:

B-Factor:	26.322
Number of residues:	26
Including
Standard Amino Acids:	22
Non Standard Amino Acids:	2
Water Molecules:	2
Cofactors:
Metals:

---

Cavity properties

Ligandability	Volume (Å3)
1.347	320.625

% Hydrophobic	% Polar
77.89	22.11
According to VolSite

HET Code:	ATZ
Formula:	C8H14ClN5
Molecular weight:	215.683 g/mol
DrugBank ID:	DB07392
Buried Surface Area:	62.2 %
Polar Surface area:	62.73 Å2

Number of
H-Bond Acceptors:	5
H-Bond Donors:	2
Rings:	1
Aromatic rings:	1
Anionic atoms:	0
Cationic atoms:	0
Rule of Five Violation:	0
Rotatable Bonds:	4

---

Mass center Coordinates

X	Y	Z
131.974	69.517	-3.66871

• 2D View
• 3D View