2OM9

ajulemic acid, a synthetic cannabinoid bound to ppar gamma

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 56
  • Norm. En. per Res.: -2.3816
• Hub Node: A(3)

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	-20.2384	17.6032	-75.2396	-77.8747	76	3	0	3995	0	15	21
A-C	-13.1615	-25.7084	-94.4977	-133.3676	56	2	1	4116	2	25	24
A-D	-6.6955	3.4551	-53.4699	-56.7103	37	2	0	2567	0	15	11

Interface residues

• A-B: ASN308A, ASN308B, ASN312A, ASN312B, ASN402B, ASP310A, ASP310B, ASP313A, ASP313B, GLN271A, GLN273A, GLN283A, GLN283B, GLN286A, GLN286B, GLN294A, GLN294B, GLN314A, GLN314B, GLN470A, GLN470B, GLU272A, GLU291A, GLU291B, GLU298A, GLU298B, GLU471A, GLU471B, GLY305B, HIS266A, HIS266B, HIS466A, HIS466B, ILE267A, ILE267B, LEU270A, LEU309A, LEU309B, LEU311A, LEU311B, LEU465A, LEU465B, LEU468A, LEU468B, LEU469A, LEU469B, LYS224A, LYS265A, LYS265B, LYS301A, LYS301B, LYS319A, LYS319B, LYS474A, LYS474B, PHE287A, PHE287B, PRO269A, PRO269B, PRO405B, PRO467A, PRO467B, SER464A, SER464B, THR268A, THR268B, THR297A, THR297B, THR316A, THR316B, VAL290A, VAL290B, VAL307A, VAL307B, VAL315A, VAL315B
• A-C: ALA209A, ALA213A, ALA215A, ALA235C, ARG212A, ARG350C, ARG357C, ASN253C, ASN335C, ASN424A, ASP210A, ASP220A, ASP251C, ASP337C, ASP380A, GLN420A, GLU207A, GLU351C, GLU427A, GLY239C, GLY338C, HIS217A, HIS425A, ILE236C, ILE249C, LEU211A, LEU237C, LEU353C, LEU356C, LEU419A, LEU421A, LEU423A, LYS216A, LYS240C, LYS336C, LYS354C, LYS422A, MET252C, MET348C, PHE247C, PHE347C, PHE352C, PRO246C, PRO426A, SER208A, SER245C, SER254C, SER355C, SER382A, SER428A, SER429A, THR238C, THR349C, TYR219A, TYR250C, VAL248C
• A-D: ALA209D, ALA215D, ARG212D, ASN253A, ASN424D, ASP251A, ASP260A, ASP380D, ASP383D, GLN273A, GLN420D, GLU427D, GLY258A, HIS425D, ILE249A, LEU211D, LEU255A, LEU419D, LEU421D, LEU423D, LYS216D, LYS244A, LYS261A, LYS422D, MET252A, MET256A, MET257A, PHE247A, PRO246A, PRO426D, SER208D, SER245A, SER254A, SER382D, TYR219D, TYR250A, VAL248A