2AB6

human glutathione s-transferase m2-2 (e.c.2.5.1.18) complexed with s-methylglutathione

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 124
  • Norm. En. per Res.: -4.6498
• 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	-19.8167	-193.1042	-352.928	-565.8489	123	11	14	13793	6	60	56
A-C	0.0	0.0	-0.5301	-0.5301	4	0	0	71	0	4	2
A-D	0.0	0.0	-0.0718	-0.0718	4	0	0	26	0	3	2
B-C	-5.2719	-2.9773	-5.7461	-13.9954	12	2	0	519	1	3	3
B-D	-15.8193	-0.6132	-74.2568	-90.6893	47	14	1	3900	1	27	20
C-D	-17.1199	-193.5998	-365.86	-576.5796	124	8	14	14224	7	61	56

Interface residues

• A-B: ALA74A, ALA74B, ARG77A, ARG77B, ARG81A, ARG81B, ARG95A, ARG95B, ASN101A, ASN101B, ASN58A, ASN58B, ASN73A, ASN73B, ASP105A, ASP105B, ASP55A, ASP55B, ASP64A, ASP64B, ASP97A, ASP97B, CYS86A, CYS86B, GLN102A, GLN102B, GLN109A, GLN109B, GLN139A, GLN139B, GLN71A, GLN71B, GLN93A, GLN93B, GLU100A, GLU100B, GLU132A, GLU132B, GLU88A, GLU88B, GLU90A, GLU90B, GLU92A, GLU92B, GLU96A, GLU96B, HIS67A, HIS67B, ILE69A, ILE69B, ILE75A, ILE75B, ILE79A, ILE79B, ILE94A, ILE94B, ILE98A, ILE98B, LEU12A, LEU134A, LEU134B, LEU136A, LEU136B, LEU141A, LEU141B, LEU163A, LEU163B, LEU54A, LEU54B, LEU62A, LEU62B, LEU76A, LEU76B, LEU99A, LEU99B, LYS112A, LYS112B, LYS135A, LYS135B, LYS49A, LYS49B, LYS68A, LYS68B, LYS82A, LYS82B, LYS91A, LYS91B, MET104A, MET104B, MET108A, MET108B, MET133A, MET133B, PHE103A, PHE103B, PHE140A, PHE140B, PHE147A, PHE147B, PHE154A, PHE154B, PHE50A, PHE50B, PHE56A, PHE56B, PRO57A, PRO57B, SER106A, SER106B, SER138A, SER138B, SER72A, SER72B, SER89A, SER89B, THR66A, THR66B, THR70A, THR70B, TYR137A, TYR137B, TYR78A, TYR78B
• A-C: ARG95C, ASP118A, LYS121A, LYS91C
• A-D: ASP118A, LYS121A, PRO117A, THR66D
• B-C: ALA37B, ASP36B, ASP39B, ASP41B, GLN139C, GLU132C, LEU136C, LYS135C, MET133C, PRO131C, PRO38B, TYR40B
• B-D: ALA212B, ALA37B, ASN216B, ASN47D, ASP116B, ASP118B, ASP39B, ASP41D, ASP64D, CYS114B, GLN44D, GLU120B, GLU28D, GLU48D, GLY215B, GLY53D, GLY65D, ILE63D, LEU46D, LEU4D, LEU52D, LEU54D, LYS121B, LYS210B, LYS217B, LYS30D, LYS31D, LYS49D, LYS51D, LYS68D, MET211B, MET2D, PHE119B, PHE50D, PRO117B, PRO1D, PRO38B, PRO57D, SER43D, THR209B, THR3D, TRP214B, TYR115B, TYR32D, TYR40B, TYR61D, VAL213B
• C-D: ALA74C, ALA74D, ARG77C, ARG77D, ARG81C, ARG81D, ARG95C, ARG95D, ASN101C, ASN101D, ASN58C, ASN58D, ASN73C, ASN73D, ASP105C, ASP105D, ASP55C, ASP55D, ASP64C, ASP64D, ASP97C, ASP97D, CYS86C, CYS86D, GLN102C, GLN102D, GLN109C, GLN109D, GLN139C, GLN139D, GLN71C, GLN71D, GLN93C, GLN93D, GLU100C, GLU100D, GLU132C, GLU132D, GLU88C, GLU88D, GLU90C, GLU90D, GLU92C, GLU92D, GLU96C, GLU96D, HIS67C, HIS67D, ILE69C, ILE69D, ILE75C, ILE75D, ILE79C, ILE79D, ILE94C, ILE94D, ILE98C, ILE98D, LEU12C, LEU12D, LEU134C, LEU134D, LEU136C, LEU136D, LEU141C, LEU141D, LEU163C, LEU163D, LEU54C, LEU54D, LEU62C, LEU62D, LEU76C, LEU76D, LEU99C, LEU99D, LYS112C, LYS112D, LYS135C, LYS135D, LYS49C, LYS49D, LYS68C, LYS68D, LYS82C, LYS82D, LYS91C, LYS91D, MET104C, MET104D, MET108C, MET108D, MET133C, MET133D, PHE103C, PHE103D, PHE140C, PHE140D, PHE147C, PHE147D, PHE154C, PHE154D, PHE50C, PHE50D, PHE56C, PHE56D, PRO57C, PRO57D, SER106C, SER106D, SER138C, SER138D, SER72C, SER72D, SER89C, SER89D, THR66C, THR66D, THR70C, THR70D, TYR137C, TYR137D, TYR78C, TYR78D