2HWR

structural basis for the structure-activity relationships of peroxisome proliferator-activated receptor agonists

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 72
  • Norm. En. per Res.: -1.3613
• Hub Node: A(1)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-6.0588	-4.4206	-87.5378	-98.0172	72	8	3	5104	1	18	18

Interface residues

• A-B: ALA213A, ALA292B, ALA300A, ARG288B, ASN308A, ASN312A, ASN312B, ASP210A, ASP220A, ASP310A, ASP310B, ASP313A, ASP313B, GLN271B, GLN283B, GLN286B, GLN294A, GLN294B, GLN314A, GLN314B, GLU272B, GLU291B, GLU295B, GLU298A, GLU298B, GLU343B, GLY284B, GLY305A, HIS217A, HIS466B, ILE223A, ILE303A, LEU214A, LEU218A, LEU309A, LEU309B, LEU311A, LEU311B, LEU318A, LEU318B, LEU401A, LEU465B, LEU468A, LYS216A, LYS224A, LYS224B, LYS301A, LYS301B, PHE287B, PHE306A, PHE306B, PRO227B, PRO304A, PRO467B, SER221A, SER225A, SER289B, SER302A, SER464B, THR297A, THR297B, THR316B, TYR219A, TYR222A, TYR299A, VAL290B, VAL293A, VAL293B, VAL307A, VAL307B, VAL315A, VAL315B