3NRU

ligand binding domain of epha7

• Total interactions analyzed: 66
• Total true interactions: 19
• Strongest Interaction:
  • Chains: J-K
  • Int. Res.: 74
  • Norm. En. per Res.: -2.5565
• Hub Node: A(5)

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	-44.7356	31.2297	-181.768	-195.2738	95	11	4	7840	4	56	59
A-C	0.0	6.4382	-53.7868	-47.3486	44	2	0	2352	0	8	8
A-F	-5.4603	0.0	-80.8789	-86.3392	53	0	4	3762	0	7	7
A-G	0.0	14.1418	-80.9461	-66.8043	44	1	0	3206	0	10	12
A-K	0.0	0.0	-0.0014	-0.0014	2	0	0	1	0	0	1
B-D	-17.8145	6.2033	-45.1457	-56.7568	36	3	0	1873	1	6	8
B-E	0.0	6.2595	-56.0057	-49.7463	43	3	0	2372	0	8	8
B-H	-11.931	5.2278	-84.5795	-91.2827	53	4	3	3937	0	5	7
B-I	0.0	0.0	-0.0072	-0.0072	4	0	0	8	0	0	0
C-G	-7.2539	8.0221	-33.0583	-32.2901	31	1	0	1554	0	7	7
C-J	-21.6264	22.7679	-159.014	-157.8726	81	3	4	7193	0	15	19
C-K	-4.9553	6.0299	-115.599	-114.5244	64	3	5	5446	0	9	12
D-E	-3.2022	18.9534	-85.3404	-69.5892	44	4	1	3253	0	10	12
E-I	-42.0942	87.0799	-201.778	-156.7923	95	7	4	7980	4	64	61
F-K	-3.5196	19.2168	-75.4753	-59.7781	41	6	0	3039	0	9	12
F-L	0.0	0.0	-2.3739	-2.3739	4	0	0	133	0	1	3
J-K	-13.9609	-13.2556	-161.961	-189.1775	74	8	8	7170	0	11	14
J-L	0.0	0.0	-12.0589	-12.0589	9	3	0	604	0	1	0
K-L	-47.1342	27.9443	-188.431	-207.6209	87	7	4	7782	3	50	55

Interface residues

• A-B: ALA150A, ALA150B, ALA151A, ALA151B, ARG172A, ARG172B, ARG97A, ARG97B, ASN110A, ASN110B, ASN124A, ASN124B, ASN168A, ASN168B, ASN64B, ASP108A, ASP108B, ASP147A, ASP147B, ASP152A, ASP152B, ASP37A, ASP37B, CB9.6378925.74028, CYS109A, CYS109B, GLU101A, GLU101B, GLU121A, GLU121B, GLU153A, GLU153B, GLU170A, GLU170B, GLU173A, GLU173B, GLU32A, GLU32A5, GLU32B, ILE146A, ILE146B, ILE149A, ILE149B, ILE174A, ILE174B, LEU102A, LEU102B, LEU106A, LEU116B, LEU167A, LEU167B, LEU34A, LEU34B, LEU35B, LEU36B, LYS103A, LYS103B, LYS120A, LYS120B, LYS145A, LYS145B, LYS199A, LYS199B, LYS203A, LYS203B, LYS204A, LYS39B, PHE104A, PHE104B, PHE123B, PHE155A, PHE99A, PHE99B, SER154A, SER154B, SER197B, THR122A, THR122B, THR148A, THR148B, THR156A, THR169A, THR169B, THR66B, TYR201A, TYR201B, TYR202B, VAL100A, VAL100B, VAL171A, VAL171B, VAL189B, VAL200A, VAL200B, VAL33B
• A-C: ARG136C, ARG139A, ARG139C, ARG86C, ASN124A, ASN137A, ASN137C, ASN141A, ASN80A, ASN82A, ASN83A, ASP131C, ASP133C, ASP188A, GLN187A, GLN81A, GLU140A, GLY135C, GLY181C, GLY190A, GLY93C, ILE138A, ILE90C, LEU142A, LEU142C, LYS120A, LYS145A, LYS180C, LYS92C, PHE123A, PRO51A, PRO79A, SER50A, SER91C, THR118A, THR130C, THR134C, TRP84A, TRP89C, TYR126A, TYR128C, TYR132C, TYR183C, VAL189A
• A-F: ALA194A, ALA40F, ARG107A, ARG69A, ARG69F, ASN168A, ASN64F, ASP37F, ASP62A, ASP62F, CYS192A, CYS74A, GLN41F, GLN42F, GLN72A, GLN75A, GLU56A, GLU57A, GLU63F, GLU78A, GLY60A, GLY60F, ILE193A, ILE58A, ILE68A, ILE68F, LEU112A, LEU167A, LEU195A, LEU34F, LEU61A, LEU61F, LYS103A, LYS166A, LYS39A, LYS39F, MET77A, PHE104A, PRO113A, PRO67A, PRO67F, SER197A, SER59A, SER59F, THR105A, THR66F, THR70A, TYR65F, TYR71A, VAL196A, VAL33F, VAL73A, VAL76A
• A-G: ARG136A, ARG139A, ARG139G, ARG86A, ASN124G, ASN137A, ASN137G, ASN141A, ASN141G, ASN80G, ASN82G, ASN83G, ASP131A, ASP133A, ASP188G, GLN187G, GLN81G, GLU129A, GLU140G, GLY135A, GLY190G, ILE138A, ILE138G, LEU142A, LEU142G, LYS120G, LYS145G, LYS179A, LYS180A, PRO51G, SER50G, SER91A, THR130A, THR134A, TRP84G, TRP89A, TYR126G, TYR128A, TYR128G, TYR132A, TYR143A, TYR143G, TYR183A, VAL189G
• A-K: GLU78A, GLU78K
• B-D: ARG139B, ARG139D, ASN137B, ASN141B, ASN53B, ASN80B, ASN82B, ASN83B, ASN94D, ASP131D, ASP133D, ASP188B, GLN81B, GLU129D, GLU140B, GLU78B, GLY135D, GLY54B, ILE138B, ILE48B, LEU142B, LEU142D, LYS179D, LYS180D, PRO51B, PRO52B, PRO79B, SER178D, SER49B, SER50B, THR130D, THR134D, TRP84B, TYR128D, TYR132D, VAL189B
• B-E: ARG136B, ARG139B, ARG139E, ARG86B, ASN124E, ASN137B, ASN137E, ASN141E, ASN80E, ASN82E, ASN83E, ASP131B, ASP133B, ASP188E, GLN187E, GLN81E, GLU140E, GLY135B, GLY181B, GLY190E, GLY93B, ILE138E, ILE90B, LEU142B, LEU142E, LYS120E, LYS145E, LYS180B, LYS92B, PRO51E, PRO79E, SER50E, SER91B, THR130B, THR134B, TRP84E, TRP89B, TYR126E, TYR128B, TYR132B, TYR143E, TYR183B, VAL189E
• B-H: ALA194B, ALA40H, ARG107B, ARG69B, ARG69H, ASN64B, ASN64H, ASP37H, ASP62B, ASP62H, CYS192B, CYS74B, GLN72B, GLN75B, GLU32H, GLU56B, GLU57B, GLU63B, GLU63H, GLY60B, GLY60H, ILE193B, ILE58B, ILE68B, ILE68H, LEU106B, LEU112B, LEU167B, LEU195B, LEU34H, LEU61B, LEU61H, LYS103B, LYS166B, LYS39H, MET165B, PHE104B, PRO113B, PRO67H, SER111B, SER59B, SER59H, THR105B, THR66B, THR66H, THR70B, TYR65B, TYR65H, TYR71B, VAL196B, VAL33H, VAL73B, VAL76B
• B-I: ARG97I, ASP131B, LYS180B, TYR132B
• C-G: ARG139C, ARG139G, ASN137C, ASN141C, ASN53C, ASN80C, ASN82C, ASN83C, ASP131G, ASP133G, GLN81C, GLU129G, GLU140C, GLU78C, ILE138C, ILE48C, LEU142G, LYS179G, LYS180G, PRO51C, PRO52C, PRO79C, SER178G, SER49C, SER50C, THR130G, THR134G, TRP84C, TYR128G, TYR132G, VAL189C
• C-J: ALA191C, ALA194C, ALA40J, ARG107C, ARG69C, ARG69J, ASN168C, ASN53C, ASN64C, ASN64J, ASN83C, ASP37C, ASP37J, ASP62C, ASP62J, CYS192C, CYS74C, GLN41J, GLN42J, GLN72C, GLN75C, GLU44J, GLU56C, GLU57C, GLU57J, GLU63C, GLU63J, GLU78C, GLY54C, GLY60C, GLY60J, ILE193C, ILE58C, ILE58J, ILE68C, ILE68J, LEU106C, LEU112C, LEU167C, LEU195C, LEU34J, LEU35J, LEU36J, LEU45J, LEU61C, LEU61J, LYS103C, LYS164C, LYS166C, LYS199C, LYS199J, LYS39C, LYS39J, MET165C, MET77C, PHE104C, PRO113C, PRO67C, PRO67J, SER111C, SER197C, SER38C, SER59C, SER59J, SER91J, THR105C, THR169C, THR43J, THR66C, THR66J, THR70C, TRP55C, TYR65C, TYR65J, TYR71C, VAL115C, VAL196C, VAL198C, VAL33J, VAL73C, VAL76C
• C-K: ALA194K, ALA40C, ARG107K, ARG69C, ARG69K, ASN110K, ASN64C, ASN64K, ASP108K, ASP37C, ASP62C, ASP62K, CYS109K, CYS192K, CYS74K, GLN72K, GLN75K, GLU32C, GLU56K, GLU57K, GLU63C, GLU63K, GLY114K, GLY60C, GLY60K, ILE193K, ILE58K, ILE68C, ILE68K, ILE90C, LEU106K, LEU112K, LEU167K, LEU195K, LEU34C, LEU35C, LEU36C, LEU61C, LEU61K, LYS103K, LYS166K, LYS199C, LYS39C, MET77K, PHE104K, PRO113K, PRO67C, SER111K, SER38C, SER59C, SER59K, THR105K, THR66C, THR66K, THR70K, TYR201C, TYR65C, TYR65K, TYR71K, VAL196K, VAL200C, VAL33C, VAL73K, VAL76K
• D-E: ARG136E, ARG139D, ARG139E, ARG86E, ASN124D, ASN137D, ASN137E, ASN141D, ASN141E, ASN80D, ASN82D, ASN83D, ASP131E, ASP133E, ASP188D, GLN187D, GLN81D, GLU129E, GLU140D, GLY135E, GLY190D, ILE138D, ILE138E, LEU142D, LEU142E, LYS120D, LYS145D, LYS179E, LYS180E, PRO51D, SER50D, SER91E, THR130E, THR134E, TRP84D, TRP89E, TYR126D, TYR128D, TYR128E, TYR132E, TYR143D, TYR143E, TYR183E, VAL189D
• E-I: ALA150E, ALA150I, ALA151E, ALA151I, ALA31E, ALA31I, ARG172E, ARG172I, ARG97E, ARG97I, ASN110E, ASN110I, ASN124E, ASN124I, ASN168E, ASN168I, ASP108E, ASP108I, ASP147E, ASP147I, ASP152E, ASP152I, ASP37E, ASP37I, CYS109E, CYS109I, CYS119I, GLU101E, GLU101I, GLU121E, GLU121I, GLU153E, GLU153I, GLU170E, GLU170I, GLU173E, GLU173I, GLU32E, GLU32I, ILE146E, ILE146I, ILE149E, ILE149I, ILE174E, ILE174I, LEU102E, LEU102I, LEU106E, LEU167E, LEU167I, LEU34E, LEU34I, LYS103E, LYS103I, LYS120E, LYS120I, LYS145E, LYS145I, LYS166E, LYS166I, LYS199E, LYS199I, LYS203E, LYS203I, LYS39E, PHE104E, PHE104I, PHE123E, PHE123I, PHE155E, PHE155I, PHE99E, PHE99I, SER154E, SER154I, SER197E, THR122E, THR122I, THR148E, THR148I, THR156E, THR156I, THR169E, THR169I, TYR201E, TYR201I, VAL100E, VAL100I, VAL171E, VAL171I, VAL189E, VAL189I, VAL198E, VAL200E, VAL200I
• F-K: ARG136F, ARG139F, ARG139K, ARG86F, ASN124K, ASN137F, ASN137K, ASN141K, ASN80K, ASN82K, ASN83K, ASP131F, ASP133F, ASP188K, GLN187K, GLN81K, GLU129F, GLU140K, GLY135F, ILE138F, ILE138K, ILE90F, LEU142F, LEU142K, LYS145K, LYS180F, PRO51K, PRO79K, SER50K, SER91F, THR130F, THR134F, THR148K, TRP84K, TRP89F, TYR126K, TYR128F, TYR132F, TYR143F, TYR183F, VAL189K
• F-L: ARG97L, ASP131F, LYS180F, TYR132F
• J-K: ALA191J, ALA194J, ALA31K, ALA40K, ARG107J, ARG69J, ARG69K, ASN110J, ASN168J, ASN53J, ASN64K, ASN94K, ASP37K, ASP62J, ASP62K, CYS109J, CYS192J, CYS74J, GLN41K, GLN72J, GLN75J, GLU32K, GLU46K, GLU56J, GLU57J, GLU57K, GLU63J, GLU63K, GLU78J, GLY60J, GLY60K, ILE193J, ILE58J, ILE58K, ILE68J, ILE68K, ILE90K, LEU106J, LEU112J, LEU116J, LEU167J, LEU195J, LEU34K, LEU35K, LEU36K, LEU61K, LYS103J, LYS166J, LYS199K, LYS204K, LYS39J, LYS39K, MET77J, PHE104J, PRO113J, PRO67K, SER111J, SER38K, SER59J, SER59K, THR105J, THR66K, THR70J, THR70K, TRP47K, TRP55J, TYR201K, TYR202K, TYR65K, TYR71J, VAL196J, VAL33K, VAL73J, VAL76J
• J-L: ARG107J, ASN110J, ASP108J, GLU153L, LEU112J, PHE155L, PRO113J, SER111J, THR156L
• K-L: ALA150K, ALA150L, ALA151K, ALA151L, ALA31K, ARG172K, ARG172L, ARG97K, ARG97L, ASN110L, ASN124K, ASN124L, ASN168K, ASN168L, ASP108L, ASP147K, ASP147L, ASP152K, ASP152L, ASP37K, CYS109L, GLU101K, GLU101L, GLU121K, GLU121L, GLU153K, GLU153L, GLU170K, GLU170L, GLU173K, GLU173L, GLU32K, GLU32L, GLY175K, ILE146K, ILE146L, ILE149K, ILE149L, ILE174K, ILE174L, LEU102K, LEU102L, LEU106L, LEU167K, LEU167L, LEU34K, LEU34L, LEU35K, LEU36K, LYS103K, LYS103L, LYS120K, LYS120L, LYS145K, LYS145L, LYS199K, LYS199L, LYS203K, LYS39K, PHE104K, PHE104L, PHE123K, PHE123L, PHE155L, PHE99K, PHE99L, SER154L, SER197K, THR122K, THR122L, THR148K, THR148L, THR156L, THR169K, THR169L, THR66K, TYR201K, TYR201L, TYR202K, VAL100K, VAL100L, VAL171K, VAL171L, VAL189K, VAL189L, VAL200K, VAL33K