3LSZ

crystal structure of glutathione s-transferase from rhodobacter sphaeroides

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 137
  • Norm. En. per Res.: -3.5592
• 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	-11.1146	-14.1471	-103.988	-129.2498	45	2	0	3990	1	4	5
A-C	-19.59	-140.2116	-327.805	-487.6067	137	10	17	14542	10	22	28
A-D	0.0	-6.6018	-37.9588	-44.5606	34	0	6	2107	0	4	6
B-D	-3.281	-133.8532	-327.57	-464.7042	136	2	18	14528	10	20	28
C-D	0.0	-18.1067	-53.0073	-71.114	41	0	0	2128	0	6	2

Interface residues

• A-B: ALA136B, ALA137B, ALA141B, ARG125A, ARG125B, ARG144B, ARG36A, ARG9A, ASN35A, GLN121A, GLN121B, GLN124A, GLN124B, GLN135A, GLN135B, GLN33A, GLU119B, GLU133A, GLU133B, GLY127A, GLY127B, GLY128A, GLY128B, GLY129A, GLY129B, GLY134A, GLY134B, ILE120B, ILE123A, ILE123B, ILE138B, LEU118A, LEU118B, LEU122A, LEU122B, PRO115B, PRO116B, PRO132A, PRO132B, SER126A, SER126B, SER131A, SER131B, THR130A, THR130B
• A-C: ALA100A, ALA100C, ALA109A, ALA109C, ALA110A, ALA110C, ALA112A, ALA112C, ALA150A, ALA150C, ALA34A, ALA34C, ALA50A, ALA50C, ALA56A, ALA56C, ALA78A, ALA78C, ARG11A, ARG11C, ARG144A, ARG144C, ARG146A, ARG146C, ARG147A, ARG147C, ARG14A, ARG14C, ARG151A, ARG151C, ARG154A, ARG154C, ARG85A, ARG85C, ASN173A, ASN173C, ASN35C, ASN58A, ASN58C, ASP99A, ASP99C, CYS65A, GLN62A, GLN62C, GLU114A, GLU114C, GLU119A, GLU68A, GLU68C, GLU69C, GLU75A, GLU75C, GLU96A, GLU96C, GLU98A, GLU98C, GLY61A, GLY61C, GLY70A, GLY70C, HIS155A, HIS155C, HIS82A, HIS82C, ILE63A, ILE63C, ILE72A, ILE72C, ILE79A, ILE79C, ILE83A, ILE83C, LEU101A, LEU101C, LEU107A, LEU107C, LEU145C, LEU149A, LEU149C, LEU152A, LEU152C, LEU55A, LEU55C, LEU60A, LEU60C, LEU66A, LEU66C, LEU71A, LEU71C, LEU73A, LEU73C, LEU77A, LEU77C, LEU81A, LEU81C, PHE108A, PHE108C, PRO115A, PRO115C, PRO148A, PRO148C, PRO59A, PRO59C, PRO93A, PRO93C, PRO97A, PRO97C, SER104A, SER104C, SER106A, SER106C, SER76A, SER76C, SER95A, SER95C, THR111A, THR111C, THR177A, THR177C, THR49A, THR49C, THR74A, THR74C, THR80A, THR80C, THR86A, THR86C, TRP105A, TRP105C, TYR54A, TYR54C, VAL103A, VAL103C, VAL113A, VAL113C, VAL57A, VAL57C
• A-D: ALA136A, ALA136D, ALA137A, ALA137D, ALA139A, ALA139D, ALA141A, ALA141D, ALA142A, ARG144A, ARG144D, ARG146A, ARG147A, GLN135A, GLN135D, GLU119D, GLU133A, GLU133D, GLU143A, GLY134A, GLY134D, ILE123D, ILE138A, ILE138D, ILE140A, ILE140D, PRO115A, PRO115D, PRO116A, PRO116D, PRO132A, PRO132D, SER131A, THR111D
• B-D: ALA100B, ALA100D, ALA109B, ALA109D, ALA110B, ALA110D, ALA112B, ALA112D, ALA150B, ALA150D, ALA34B, ALA34D, ALA50B, ALA50D, ALA56B, ALA56D, ALA78B, ALA78D, ARG11B, ARG11D, ARG144B, ARG144D, ARG146B, ARG146D, ARG147B, ARG147D, ARG14B, ARG14D, ARG151B, ARG151D, ARG154B, ARG154D, ARG85B, ARG85D, ASN173B, ASN173D, ASN35D, ASN58B, ASN58D, ASP99B, ASP99D, CYS65B, GLN62B, GLN62D, GLU114B, GLU114D, GLU68B, GLU68D, GLU69B, GLU69D, GLU75B, GLU75D, GLU96B, GLU96D, GLU98B, GLU98D, GLY61B, GLY61D, GLY70B, GLY70D, HIS155B, HIS155D, HIS82B, HIS82D, ILE63D, ILE72B, ILE72D, ILE79B, ILE79D, ILE83B, ILE83D, LEU101B, LEU101D, LEU107B, LEU107D, LEU145B, LEU145D, LEU149B, LEU149D, LEU152B, LEU152D, LEU55B, LEU55D, LEU60B, LEU60D, LEU66B, LEU66D, LEU71B, LEU71D, LEU73B, LEU73D, LEU77B, LEU77D, LEU81B, LEU81D, PHE108B, PHE108D, PRO115B, PRO115D, PRO148B, PRO148D, PRO59B, PRO59D, PRO93B, PRO93D, PRO97B, PRO97D, SER104B, SER104D, SER106B, SER106D, SER76B, SER76D, SER95B, SER95D, THR111B, THR111D, THR177B, THR177D, THR49B, THR49D, THR74B, THR74D, THR80B, THR80D, THR86B, THR86D, TRP105B, TRP105D, TYR54D, VAL103B, VAL103D, VAL113B, VAL113D, VAL57B, VAL57D
• C-D: ALA136C, ALA137C, ALA34C, ALA34D, ALA38D, ARG125C, ARG125D, ARG36D, ASN35C, ASN35D, GLN121C, GLN124C, GLN124D, GLN135C, GLN33D, GLU119C, GLU133C, GLU133D, GLY127C, GLY127D, GLY128C, GLY128D, GLY129D, GLY134C, GLY134D, HIS39D, ILE120C, ILE123C, ILE32D, LEU118C, LEU122C, PRO132C, PRO132D, PRO40D, SER126C, SER126D, SER131C, SER131D, THR130C, THR130D, VAL37D