3I9S

structure from the mobile metagenome of v.cholerae. integron cassette protein vch_cass6

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 223
  • Norm. En. per Res.: -6.5532
• 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	-352.9502	8.8702	-1101.25	-1445.33	224	64	40	39494	6	60	69
A-C	0.0	36.5916	-99.4348	-62.8432	59	5	1	4467	0	30	33
A-D	0.0	14.5374	-43.2593	-28.7219	32	0	0	1730	0	9	8
B-C	0.0	2.2367	-20.4763	-18.2396	26	0	0	849	0	0	1
B-D	-17.3334	24.3107	-112.256	-105.2787	60	3	1	5067	1	30	32
C-D	-358.7449	14.1348	-1116.75	-1461.3602	223	52	40	39402	7	58	66

Interface residues

• A-B: ALA108A, ALA108B, ALA111A, ALA111B, ALA123A, ALA123B, ALA130A, ALA130B, ALA139A, ALA139B, ALA159A, ALA159B, ALA32A, ALA32B, ALA33A, ALA33B, ALA39A, ALA39B, ALA68A, ALA68B, ALA76A, ALA76B, ARG118A, ARG118B, ARG143A, ARG143B, ARG149A, ARG149B, ASN115A, ASN115B, ASN127A, ASN127B, ASN153A, ASN153B, ASN156A, ASN156B, ASN40A, ASN40B, ASP120A, ASP120B, ASP37A, ASP37B, ASP87A, ASP87B, CYS116A, CYS116B, GLN102A, GLN102B, GLN117A, GLN117B, GLN36A, GLN36B, GLN45A, GLN45B, GLN82A, GLN82B, GLU124A, GLU124B, GLU144A, GLU144B, GLU146A, GLU146B, GLU151A, GLU151B, GLU24A, GLU24B, GLU49A, GLU49B, GLY100A, GLY100B, GLY131A, GLY131B, GLY138A, GLY138B, GLY152A, GLY152B, GLY154A, GLY154B, GLY52A, GLY52B, GLY81A, GLY81B, HIS106A, HIS106B, HIS114A, HIS114B, HIS44A, HIS44B, HIS50A, HIS50B, ILE110A, ILE110B, ILE112A, ILE112B, ILE137A, ILE137B, ILE142A, ILE142B, ILE19A, ILE19B, ILE21A, ILE5B, ILE72A, ILE72B, LEU101A, LEU101B, LEU103A, LEU103B, LEU107A, LEU107B, LEU119A, LEU119B, LEU141A, LEU141B, LEU155A, LEU155B, LEU158A, LEU158B, LEU162A, LEU16A, LEU16B, LEU23A, LEU23B, LEU38A, LEU38B, LEU42A, LEU42B, LEU79A, LEU79B, LEU88A, LEU88B, LYS105A, LYS105B, LYS132A, LYS132B, LYS135A, LYS135B, LYS145A, LYS145B, LYS157A, LYS157B, LYS160A, LYS160B, LYS31A, LYS31B, LYS54A, LYS54B, LYS78A, LYS78B, LYS86A, LYS86B, PHE133A, PHE133B, PHE150A, PHE150B, PHE20A, PHE20B, PHE28A, PHE28B, PHE47A, PHE47B, PHE67A, PHE67B, PHE74A, PHE74B, PHE89A, PHE89B, PRO128A, PRO128B, PRO75A, PRO75B, PRO77A, PRO77B, SER125A, SER125B, SER136A, SER136B, SER140A, SER140B, SER161A, SER161B, SER34A, SER34B, SER48A, SER48B, SER51A, SER51B, SER80A, SER80B, THR109A, THR109B, THR113A, THR113B, THR122A, THR122B, THR126A, THR126B, THR129B, THR69A, THR69B, THR71A, THR71B, TRP121A, TRP121B, TYR134A, TYR134B, TYR147A, TYR147B, TYR148A, TYR148B, TYR27A, TYR27B, TYR41A, TYR41B, TYR70A, TYR70B, TYR84A, TYR84B, VAL46A, VAL46B, VAL53A, VAL53B, VAL55A, VAL55B
• A-C: ALA108C, ALA111C, ALA39A, ALA57C, ARG7C, ASN40A, ASP15A, ASP15C, ASP37A, ASP62C, ASP9A, ASP9C, CYS13A, GLN102C, GLN36A, GLN45A, GLU35A, GLU49A, GLU4C, HIS106C, HIS114C, HIS11A, HIS11C, HIS12A, HIS12C, HIS44A, HIS50A, ILE110C, ILE112C, ILE56C, ILE5C, ILE99C, LEU103C, LEU107C, LEU14A, LEU162A, LEU38A, LEU42A, LEU79C, LYS105C, LYS10A, LYS10C, LYS54C, LYS6C, PHE47A, PHE47C, SER2C, SER34A, SER43A, SER48A, THR109C, THR113C, TYR41A, TYR70C, VAL17A, VAL3C, VAL55C, VAL59C, VAL8C
• A-D: ALA159A, ALA159D, ALA39A, ALA39D, ASN40A, ASN40D, ASP37A, ASP37D, GLN36A, GLN36D, GLU35A, GLU35D, GLU49A, GLU49D, HIS44A, HIS44D, HIS50A, HIS50D, LEU162A, LEU162D, LEU38A, LEU38D, LYS160A, LYS160D, SER161A, SER161D, SER34A, SER34D, SER48A, SER48D, TYR41A, TYR41D
• B-C: ASN115B, ASN115C, CYS116B, CYS116C, GLN117B, GLN117C, GLY81B, GLY81C, HIS114B, HIS114C, ILE110B, ILE110C, ILE112B, ILE112C, LEU79B, LEU79C, LYS78B, LYS78C, PHE74B, PHE74C, SER80B, SER80C, THR109B, THR109C, THR113B, THR113C
• B-D: ALA108B, ALA111B, ALA39D, ALA57B, ARG7B, ASN40D, ASP15D, ASP37D, ASP9B, ASP9D, CYS13B, CYS13D, GLN102B, GLN36D, GLN45D, GLU35D, GLU49D, GLU4B, GLY0B, GLY18D, HIS106B, HIS114B, HIS11B, HIS11D, HIS12B, HIS12D, HIS44D, HIS50D, ILE110B, ILE112B, ILE21D, ILE56B, ILE5B, LEU103B, LEU107B, LEU14D, LEU162D, LEU38D, LEU42D, LEU79B, LYS105B, LYS10B, LYS10D, LYS54B, LYS63D, LYS6B, PHE47D, SER2B, SER43D, SER48D, THR109B, THR113B, TYR41D, TYR70B, VAL17D, VAL3B, VAL46D, VAL55B, VAL59B, VAL8B
• C-D: ALA108C, ALA108D, ALA111C, ALA111D, ALA123C, ALA123D, ALA130C, ALA130D, ALA139C, ALA139D, ALA159C, ALA159D, ALA32C, ALA32D, ALA33C, ALA33D, ALA39C, ALA39D, ALA68C, ALA68D, ALA76C, ALA76D, ARG118C, ARG118D, ARG143C, ARG143D, ARG149C, ARG149D, ASN115C, ASN115D, ASN127C, ASN127D, ASN153C, ASN153D, ASN156C, ASN156D, ASN40C, ASN40D, ASP120C, ASP120D, ASP37C, ASP37D, ASP87C, ASP87D, CYS116C, CYS116D, GLN102C, GLN102D, GLN117C, GLN117D, GLN36C, GLN36D, GLN45C, GLN45D, GLN82C, GLN82D, GLU124C, GLU124D, GLU144C, GLU144D, GLU146C, GLU146D, GLU151C, GLU151D, GLU24C, GLU24D, GLU49C, GLU49D, GLY100C, GLY100D, GLY131C, GLY131D, GLY138C, GLY138D, GLY152C, GLY152D, GLY154C, GLY154D, GLY52C, GLY52D, GLY81C, GLY81D, HIS106C, HIS106D, HIS114C, HIS114D, HIS44C, HIS44D, HIS50C, HIS50D, ILE110C, ILE110D, ILE112C, ILE112D, ILE137C, ILE137D, ILE142C, ILE142D, ILE19C, ILE19D, ILE5C, ILE72C, ILE72D, LEU101C, LEU101D, LEU103C, LEU103D, LEU107C, LEU107D, LEU119C, LEU119D, LEU141C, LEU141D, LEU155C, LEU155D, LEU158C, LEU158D, LEU162D, LEU16C, LEU16D, LEU23C, LEU23D, LEU38C, LEU38D, LEU42C, LEU42D, LEU79C, LEU79D, LEU88C, LEU88D, LYS105C, LYS105D, LYS132C, LYS132D, LYS135C, LYS135D, LYS145C, LYS145D, LYS157C, LYS157D, LYS160C, LYS160D, LYS31C, LYS31D, LYS54C, LYS54D, LYS78C, LYS78D, LYS86C, LYS86D, PHE133C, PHE133D, PHE150C, PHE150D, PHE20C, PHE20D, PHE28C, PHE28D, PHE47C, PHE47D, PHE67C, PHE67D, PHE74C, PHE74D, PHE89C, PHE89D, PRO128C, PRO128D, PRO75C, PRO75D, PRO77C, PRO77D, SER125C, SER125D, SER136C, SER136D, SER140C, SER140D, SER161C, SER161D, SER34C, SER34D, SER48C, SER48D, SER51C, SER51D, SER80C, SER80D, THR109C, THR109D, THR113C, THR113D, THR122C, THR122D, THR126C, THR126D, THR129C, THR69C, THR69D, THR71C, THR71D, TRP121C, TRP121D, TYR134C, TYR134D, TYR147C, TYR147D, TYR148C, TYR148D, TYR27C, TYR27D, TYR41C, TYR41D, TYR70C, TYR70D, TYR84C, TYR84D, VAL46C, VAL46D, VAL53C, VAL53D, VAL55C, VAL55D