2E55

structure of aq2163 protein from aquifex aeolicus

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 20
  • Norm. En. per Res.: -6.6915
• 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	-86.6227	52.3477	-337.286	-371.561	121	33	9	14119	0	37	41
A-C	-41.6124	-54.8978	-28.0305	-124.5407	20	4	0	1100	6	22	15
A-D	-74.0604	-51.9955	-701.486	-827.5418	184	18	12	26526	2	58	50
B-C	-87.2721	-67.05	-736.634	-890.956	179	20	12	26831	4	57	49
B-D	-45.5753	-58.3227	-29.9328	-133.8307	20	4	0	1081	6	22	16
C-D	-83.5427	72.7924	-333.873	-344.6232	120	36	9	13833	0	35	40

Interface residues

• A-B: ALA204A, ALA204B, ALA24A, ALA24B, ALA78A, ALA78B, ALA86B, ALA93A, ALA93B, ARG102A, ARG102B, ARG115A, ARG115B, ARG201A, ARG201B, ARG28A, ARG28B, ARG77A, ARG77B, ASN92A, ASN92B, ASP197A, ASP197B, ASP200A, ASP200B, GLN88A, GLN88B, GLU104A, GLU104B, GLU118A, GLU118B, GLU25A, GLU25B, GLU67A, GLU67B, GLU68A, GLU68B, GLU84A, GLU84B, GLY199A, GLY199B, GLY85A, GLY85B, GLY96A, GLY96B, GLY99A, GLY99B, HIS110A, HIS110B, ILE100A, ILE100B, ILE111A, ILE111B, ILE198A, ILE198B, ILE70A, ILE70B, ILE75A, ILE75B, LEU116A, LEU116B, LEU202A, LEU202B, LEU27A, LEU27B, LEU76A, LEU76B, LEU80A, LEU80B, LEU83A, LEU83B, LEU87A, LEU87B, LEU98A, LEU98B, LYS101A, LYS101B, LYS122A, LYS122B, LYS26A, LYS26B, LYS29A, LYS29B, LYS32A, LYS32B, LYS94A, LYS94B, PHE72A, PHE72B, PHE97A, PHE97B, PRO117A, PRO117B, PRO74A, PRO74B, PRO91A, PRO91B, SER114A, SER114B, SER206A, SER206B, SER23A, SER23B, SER81A, SER81B, THR22A, THR22B, TYR112A, TYR112B, TYR113A, TYR113B, TYR203A, TYR203B, VAL205A, VAL205B, VAL71A, VAL71B, VAL90A, VAL90B, VAL95A, VAL95B
• A-C: ARG28A, ARG28C, GLU25A, GLU25C, GLU33A, GLU33C, LYS13A, LYS13C, LYS26A, LYS26C, LYS29A, LYS29C, LYS32A, LYS32C, SER23A, SER23C, THR16A, THR16C, THR30A, THR30C
• A-D: ALA17A, ALA17D, ALA42A, ALA42D, ALA86A, ALA86D, ARG184A, ARG184D, ARG18A, ARG18D, ARG201A, ARG201D, ARG54A, ARG54D, ARG61A, ARG61D, ASN15A, ASN15D, ASN180A, ASN180D, ASN186A, ASN186D, ASN59A, ASN63A, ASN63D, ASN66A, ASN66D, ASN92A, ASN92D, ASP182A, ASP182D, ASP197A, ASP197D, ASP21A, ASP21D, ASP45A, ASP45D, GLN20A, GLN20D, GLN88A, GLN88D, GLU183A, GLU183D, GLU33A, GLU33D, GLU41A, GLU41D, GLU49A, GLU49D, GLU50A, GLU50D, GLU52A, GLU52D, GLU67A, GLU67D, GLU84A, GLU84D, GLY179D, GLY189A, GLY189D, GLY194A, GLY194D, GLY196A, GLY196D, GLY35A, GLY35D, GLY58A, GLY58D, GLY85A, GLY85D, HIS12A, HIS12D, HIS7A, HIS7D, ILE10A, ILE10D, ILE158A, ILE158D, ILE191A, ILE191D, ILE192A, ILE192D, ILE198A, ILE198D, ILE19A, ILE19D, ILE46A, ILE46D, ILE57A, ILE57D, ILE70A, ILE70D, LEU185A, LEU185D, LEU195A, LEU195D, LEU34A, LEU34D, LEU38A, LEU38D, LEU43A, LEU43D, LEU47A, LEU47D, LEU48A, LEU48D, LEU5A, LEU5D, LEU65A, LEU65D, LEU87A, LEU87D, LEU9A, LEU9D, LYS11A, LYS11D, LYS13A, LYS13D, LYS153D, LYS188A, LYS188D, LYS26A, LYS26D, LYS29A, LYS29D, LYS32A, LYS32D, LYS44A, LYS44D, LYS51A, LYS51D, LYS60A, LYS60D, MET130A, MET130D, MET37A, MET37D, PHE36A, PHE36D, PHE62A, PHE62D, PHE72A, PHE72D, PRO193A, PRO193D, PRO8A, PRO8D, PRO91A, PRO91D, SER206A, SER206D, SER6A, SER6D, THR16A, THR16D, THR22A, THR22D, THR30A, THR30D, THR55A, THR55D, TRP56A, TRP56D, TYR190A, TYR190D, TYR208A, TYR208D, TYR40A, TYR40D, TYR64A, TYR64D, VAL125D, VAL14A, VAL14D, VAL207A, VAL207D, VAL39A, VAL39D, VAL53A, VAL53D, VAL89A, VAL89D, VAL90A, VAL90D
• B-C: ALA17B, ALA17C, ALA42B, ALA42C, ALA86B, ALA86C, ARG184B, ARG184C, ARG18B, ARG18C, ARG201B, ARG201C, ARG54B, ARG54C, ARG61B, ARG61C, ASN15B, ASN15C, ASN180B, ASN180C, ASN186B, ASN186C, ASN59B, ASN59C, ASN63B, ASN63C, ASN66B, ASN66C, ASN92B, ASN92C, ASP182B, ASP182C, ASP197B, ASP197C, ASP21B, ASP21C, ASP45B, ASP45C, GLN20B, GLN20C, GLN88B, GLN88C, GLU183B, GLU183C, GLU33B, GLU33C, GLU41B, GLU41C, GLU49B, GLU49C, GLU50B, GLU50C, GLU52B, GLU52C, GLU67B, GLU67C, GLU84B, GLU84C, GLY189B, GLY189C, GLY194B, GLY194C, GLY196B, GLY196C, GLY35B, GLY35C, GLY58B, GLY58C, GLY85B, GLY85C, HIS12B, HIS12C, HIS7B, HIS7C, ILE10B, ILE10C, ILE158B, ILE158C, ILE191B, ILE191C, ILE192B, ILE192C, ILE19B, ILE19C, ILE46B, ILE46C, ILE57B, ILE57C, ILE70B, ILE70C, LEU185B, LEU195B, LEU195C, LEU34B, LEU34C, LEU38B, LEU38C, LEU43B, LEU43C, LEU47B, LEU47C, LEU48B, LEU48C, LEU5B, LEU5C, LEU65B, LEU65C, LEU87B, LEU87C, LEU9B, LEU9C, LYS11B, LYS11C, LYS13B, LYS13C, LYS188B, LYS188C, LYS26B, LYS26C, LYS29B, LYS29C, LYS32B, LYS32C, LYS44B, LYS44C, LYS51B, LYS51C, LYS60B, LYS60C, MET130B, MET130C, MET37B, MET37C, PHE36B, PHE36C, PHE62B, PHE62C, PHE72B, PHE72C, PRO193B, PRO193C, PRO8B, PRO8C, PRO91B, PRO91C, SER206B, SER206C, SER6B, SER6C, THR16B, THR16C, THR22B, THR22C, THR30B, THR30C, THR55B, THR55C, TRP56B, TRP56C, TYR190B, TYR190C, TYR208B, TYR208C, TYR40B, TYR40C, TYR64B, TYR64C, VAL14B, VAL14C, VAL207B, VAL207C, VAL39B, VAL39C, VAL53B, VAL53C, VAL89B, VAL89C, VAL90B, VAL90C
• B-D: ARG28B, ARG28D, GLU25B, GLU25D, GLU33B, GLU33D, LYS13B, LYS13D, LYS26B, LYS26D, LYS29B, LYS29D, LYS32B, LYS32D, SER23B, SER23D, THR16B, THR16D, THR30B, THR30D
• C-D: ALA204C, ALA204D, ALA24C, ALA24D, ALA78C, ALA78D, ALA86C, ALA86D, ALA93C, ALA93D, ARG102C, ARG102D, ARG115C, ARG115D, ARG201C, ARG201D, ARG28C, ARG28D, ARG77C, ARG77D, ASN92C, ASN92D, ASP197C, ASP197D, ASP200C, ASP200D, GLN88C, GLN88D, GLU104C, GLU104D, GLU118C, GLU118D, GLU25C, GLU25D, GLU67C, GLU67D, GLU68C, GLU68D, GLU84C, GLU84D, GLY199C, GLY199D, GLY85C, GLY85D, GLY96C, GLY96D, GLY99C, GLY99D, HIS110C, HIS110D, ILE100C, ILE100D, ILE111C, ILE111D, ILE198C, ILE70D, ILE75C, ILE75D, LEU116C, LEU116D, LEU202C, LEU202D, LEU27C, LEU27D, LEU76C, LEU76D, LEU80C, LEU80D, LEU83C, LEU83D, LEU87C, LEU87D, LEU98C, LEU98D, LYS101C, LYS101D, LYS122C, LYS122D, LYS26C, LYS26D, LYS29C, LYS29D, LYS32C, LYS32D, LYS94C, LYS94D, PHE72C, PHE72D, PHE97C, PHE97D, PRO117C, PRO117D, PRO74C, PRO74D, PRO91C, PRO91D, SER114C, SER114D, SER206C, SER206D, SER23C, SER23D, SER81C, SER81D, THR22C, THR22D, TYR112C, TYR112D, TYR113C, TYR113D, TYR203C, TYR203D, VAL205C, VAL205D, VAL71C, VAL71D, VAL90C, VAL90D, VAL95C, VAL95D